SCHEMBL681071

SCHEMBL681071

Clc1nc2ccccc2cc1CBr

nearest known ligand 0.70

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.70
ALDH1A1 P00352 5/20 0.46
MAPT P10636 2/20 0.46
TDP1 Q9NUW8 2/20 0.46
GLA P06280 1/20 0.46
HPGD P15428 1/20 0.46
ACHE P22303 1/20 0.46
PDE10A Q9Y233 1/20 0.45
NPSR1 Q6W5P4 1/20 0.42
FAAH O00519 1/20 0.42
KDM4E B2RXH2 3/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
TLR8 Q9NR97 2/20 0.40
MEN1 O00255 1/20 0.40
GFER P55789 1/20 0.39
EGFR P00533 1/20 0.39
TOP2A P11388 1/20 0.39
TOP2B Q02880 1/20 0.39
HTT P42858 1/20 0.38

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL29518150 1.00 KMT2A (0.70) KMT2AALDH1A1MAPTTDP1GLA
SCHEMBL27591796 0.85 KMT2A (0.66) KMT2AALDH1A1MAPTTDP1GLA
SCHEMBL30162631 0.82 KMT2A (1.00) KMT2AALDH1A1MAPTTDP1GLA
SCHEMBL377259 0.82 KMT2A (1.00) KMT2AALDH1A1MAPTTDP1GLA
SCHEMBL8735682 0.81 KMT2A (0.70) KMT2AALDH1A1MAPTTDP1GLA
SCHEMBL4358158 0.81 KMT2A (0.70) KMT2AALDH1A1MAPTTDP1GLA
SCHEMBL120913 0.81 KMT2A (0.70) KMT2AALDH1A1MAPTTDP1GLA
SCHEMBL13067261 0.81 KMT2A (0.70) KMT2AALDH1A1MAPTTDP1GLA
SCHEMBL12413527 0.80 KMT2A (0.64) KMT2AALDH1A1MAPTTDP1GLA
SCHEMBL6772400 0.78 ALDH1A1 (0.48) KMT2AALDH1A1MAPTTDP1GLA

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 56 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11560389-B2 Heterocyclic inhibitors of monocarboxylate transporters UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INCORPORATED (US) 2023-01-24 US disclosed
US-20210094969-A1 HETEROCYCLIC INHIBITORS OF MONOCARBOXYLATE TRANSPORTERS UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INCORPORATED 2021-04-01 US disclosed
US-10851113-B2 Heterocyclic inhibitors of monocarboxylate transporters THE SCRIPPS RESEARCH INSTITUTE (US) 2020-12-01 US disclosed
US-20190330228-A1 HETEROCYCLIC INHIBITORS OF MONOCARBOXYLATE TRANSPORTERS UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INCORPORATED 2019-10-31 US disclosed
EP-2432776-B1 METHYL SULFANYL PYRIMIDINES USEFUL AS ANTIINFLAMMATORIES, ANALGESICS, AND ANTIEPILEPTICS UNIV LAVAL (CA) 2019-09-11 EP disclosed
EP-2432776-B1 METHYL SULFANYL PYRIMIDINES USEFUL AS ANTIINFLAMMATORIES, ANALGESICS, AND ANTIEPILEPTICS UNIV LAVAL (CA) 2019-09-11 EP disclosed
US-10329303-B2 Heterocyclic inhibitors of monocarboxylate transporter THE SCRIPPS RESEARCH INSTITUTE (US) 2019-06-25 US disclosed
US-20180002343-A1 HETEROCYCLIC INHIBITORS OF MONOCARBOXYLATE TRANSPORTERS UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INCORPORATED 2018-01-04 US disclosed
EP-3247360-A1 HETEROCYCLIC INHIBITORS OF MONOCARBOXYLATE TRANSPORTERS The Scripps Research Institute (US) 2017-11-29 EP disclosed
US-9790228-B2 Heterocyclic kinase inhibitors INTELLIKINE LLC (US) 2017-10-17 US disclosed
EP-1208097-A2 SUBSTITUTED OXOAZAHETEROCYCLYL COMPOUNDS Aventis Pharmaceuticals Inc. (US) 2002-05-29 EP disclosed
EP-1042323-B1 NOVEL CAMPTOTHECIN TETRACYCLIC ANALOGUES, PREPARATION, METHODS, APPLICATIONS AS MEDICINES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SOD CONSEILS RECH APPLIC (FR) 2002-04-10 EP disclosed
US-20010000521-A1 New tetracyclic analogues of camptothecins, their preparation processes, their use as medicaments and the pharmaceutical compositions containing them IPSEN PHARMA S.A.S. (FR) 2001-04-26 US disclosed
CN-1291892-A Substituted oxoazaheterocyclyl factor Xa inhibitors AWENTIS PHARMACEUTICAL INC (US) 2001-04-18 CN disclosed
WO-2001007436-A2 SUBSTITUTED OXOAZAHETEROCYCLYL COMPOUNDS AVENTIS PHARMACEUTICALS INC. (US) 2001-02-01 WO disclosed
EP-1051176-A1 SUBSTITUTED OXOAZAHETEROCYCLYL FACTOR Xa INHIBITORS Aventis Pharmaceuticals Products Inc. (US) 2000-11-15 EP disclosed
EP-1042323-A1 NOVEL CAMPTOTHECIN TETRACYCLIC ANALOGUES, PREPARATION, METHODS, APPLICATIONS AS MEDICINES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SOCIETE DE CONSEILS DE RECHERCHES ET D'APPLICATIONS SCIENTIFIQUES (S.C.R.A.S.) (FR) 2000-10-11 EP disclosed
WO-2000032590-A1 SUBSTITUTED OXOAZAHETEROCYCLYL FACTOR Xa INHIBITORS AVENTIS PHARMACEUTICALS PRODUCTS INC. (US) 2000-06-08 WO disclosed
WO-1999037304-A1 SUBSTITUTED OXOAZAHETEROCYCLYL FACTOR Xa INHIBITORS AVENTIS PHARMACEUTICALS PRODUCTS INC. (US) 1999-07-29 WO disclosed
WO-1999033829-A1 NOVEL CAMPTOTHECIN TETRACYCLIC ANALOGUES, PREPARATION, METHODS, APPLICATIONS AS MEDICINES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SOCIETE DE CONSEILS DE RECHERCHES ET D'APPLICATIONS SCIENTIFIQUES (S.C.R.A.S.) (FR) 1999-07-08 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (7 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20180002343-A1 HETEROCYCLIC INHIBITORS OF MONOCARBOXYLATE TRANSPORTERS SLC16A1, SLC16A3, SLC16A7 KMT2A 783/4885ALDH1A1 742/4885MAPT 1112/4885
US-10851113-B2 Heterocyclic inhibitors of monocarboxylate transporters SLC16A1, SLC16A3, SLC16A7 KMT2A 1296/4885ALDH1A1 353/4885MAPT 1981/4885
US-20210094969-A1 HETEROCYCLIC INHIBITORS OF MONOCARBOXYLATE TRANSPORTERS SLC16A1, SLC16A3, SLC16A7 KMT2A 1334/4885ALDH1A1 402/4885MAPT 1760/4885
US-11560389-B2 Heterocyclic inhibitors of monocarboxylate transporters SLC16A1, SLC16A3, SLC16A7 KMT2A 1334/4885ALDH1A1 402/4885MAPT 1760/4885
US-20010000521-A1 New tetracyclic analogues of camptothecins, their preparation processes, their use as medicaments and the pharmaceutical compositions containing them TOP2A, TOP1, TOP2B KMT2A 3036/4885ALDH1A1 1774/4885MAPT 3218/4885
US-20190330228-A1 HETEROCYCLIC INHIBITORS OF MONOCARBOXYLATE TRANSPORTERS SLC16A1, SLC16A3, SLC16A7 KMT2A 783/4885ALDH1A1 742/4885MAPT 1112/4885
US-10329303-B2 Heterocyclic inhibitors of monocarboxylate transporter SLC16A1, SLC16A3, SLC16A7 KMT2A 787/4885ALDH1A1 651/4885MAPT 1038/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.