SCHEMBL4395595

SCHEMBL4395595

O=C(CCl)Nc1ccccc1C(=O)O

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.73
KMT2A Q03164 5/20 0.65
MEN1 O00255 3/20 0.61
LMNA P02545 3/20 0.61
KDM4E B2RXH2 4/20 0.59
L3MBTL1 Q9Y468 1/20 0.59
POLB P06746 1/20 0.59
MAPT P10636 1/20 0.59
CTSK P43235 1/20 0.59
HPGD P15428 3/20 0.59
CYP2C9 P11712 1/20 0.59
BLM P54132 1/20 0.57
RECQL P46063 1/20 0.56
SMN1; SMN2 Q16637 3/20 0.55
PTGER4 P35408 1/20 0.55
HSD17B10 Q99714 1/20 0.54
CFD P00746 1/20 0.54
HCAR2 Q8TDS4 2/20 0.54
NPC1 O15118 2/20 0.54
RAB9A P51151 2/20 0.54

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
SCHEMBL31439507 1.00 ALDH1A1 (0.73) ALDH1A1KMT2AMEN1LMNAKDM4E
SCHEMBL10501327 0.86 KMT2A (0.83) ALDH1A1KMT2AMEN1LMNAKDM4E
SCHEMBL10911824 0.85 ALDH1A1 (0.68) ALDH1A1KMT2AMEN1LMNAKDM4E
SCHEMBL16404495 0.85 KMT2A (0.69) ALDH1A1KMT2AMEN1LMNAKDM4E
SCHEMBL6691248 0.84 ALDH1A1 (0.58) ALDH1A1KMT2AMEN1LMNAKDM4E
SCHEMBL31541283 0.84 ALDH1A1 (1.00) ALDH1A1KMT2AMEN1LMNAMAPT
SCHEMBL10814639 0.84 ALDH1A1 (1.00) ALDH1A1KMT2AMEN1LMNAMAPT
SCHEMBL4011016 0.84 ALDH1A1 (0.65) ALDH1A1KMT2AMEN1LMNAKDM4E
SCHEMBL10914318 0.84 ALDH1A1 (0.66) ALDH1A1KMT2AMEN1LMNAKDM4E
SCHEMBL138820 0.83 KMT2A (0.72) ALDH1A1KMT2AMEN1LMNAKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-8119918-A None JP disclosed
US-20250145617-A1 SIGMA-2 RECEPTOR LIGAND DRUG CONJUGATES AS ANTITUMOR COMPOUNDS, METHODS OF SYNTHESIS AND USES THEREOF WASHINGTON UNIVERSITY 2025-05-08 US disclosed
WO-2025015167-A2 ERASTIN KETONE ANALOGS AND USES THEREOF EXARTA THERAPEUTICS, INC. (US) 2025-01-16 WO disclosed
EP-3684776-B1 HETEROCYCLYL SUBSTITUTED PYRROLOPYRIDINES THAT ARE INHIBITORS OF THE CDK12 KINASE UNIV NOTTINGHAM (GB) 2023-11-01 EP disclosed
US-11407767-B2 Heterocyclyl substituted pyrrolopyridines that are inhibitors of the CDK12 kinase UNIV NOTTINGHAM (GB) 2022-08-09 US disclosed
CN-108201625-B Linker drugs and antibody drug complexes comprising the same 财团法人工业技术研究院 2022-06-07 CN disclosed
CN-114026063-A Bis (2-haloacetamido) -compounds useful as linkers and resulting products comprising antibodies, half-antibodies and antibody fragments 巴斯大学 2022-02-08 CN disclosed
EP-3318561-B1 HETEROARYL COMPOUNDS AND METHODS OF USE THEREOF SUNOVION PHARMACEUTICALS INC (US) 2021-12-22 EP disclosed
EP-3318561-B1 HETEROARYL COMPOUNDS AND METHODS OF USE THEREOF SUNOVION PHARMACEUTICALS INC (US) 2021-12-22 EP disclosed
US-20210221805-A1 SIGMA-2 RECEPTOR LIGAND DRUG CONJUGATES AS ANTITUMOR COMPOUNDS, METHODS OF SYNTHESIS AND USES THEREOF WASHINGTON UNIVERSITY 2021-07-22 US disclosed
JP-H08119918-A MIXED POLYVALENT METAL SALT, POLYVALENT METAL SALT COMPOSITION CONTAINING THE SAME AND RECORDING MATERIAL MITSUI TOATSU CHEM INC 1996-05-14 JP disclosed
EP-0292846-B1 A process for the extraction of docosahexaenoic acid ethyl ester from fish oils and pharmaceutical and/or dietetic compositions containing a mixture of docosahexaenoic and eicosapentaenoic acid ethyl esters STAR OIL LTD (GB) 1994-08-17 EP disclosed
US-5217961-A High carcinostatic activity; inhibiting KB-cell growth MECT CORPORATION (JP) 1993-06-08 US disclosed
US-4977258-A Benzoxazepinone process MERCK, SHARP & DOHME LTD. (GB) 1990-12-11 US disclosed
EP-0376166-A1 Condensed quinoline system compound and process of preparation thereof MECT CORPORATION (JP) 1990-07-04 EP disclosed
EP-0362942-A2 Benzoxazepinone process MERCK SHARP & DOHME LTD. (GB) 1990-04-11 EP disclosed
EP-0292846-A2 A process for the extraction of docosahexaenoic acid ethyl ester from fish oils and pharmaceutical and/or dietetic compositions containing a mixture of docosahexaenoic and eicosapentaenoic acid ethyl esters STAR OIL LTD (GB) 1988-11-30 EP disclosed
US-4187306-A Benzodiazepine-diones, a process for their production and their use as medicaments BAYER AKTIENGESELLSCHAFT (DE) 1980-02-05 US disclosed
US-4183931-A SEDATIVE-HYPNOTICS, ANTICONVULSANTS, CENTRAL NERVOUS SYSTEM DEPRESSANTS RESEARCH CORPORATION (US) 1980-01-15 US disclosed
EP-0000538-A1 6,7-Dihydro-5H,13H-quinazolino(3,2-a)(1,4)benzodiazepine-5,13-diones, process for their preparation and their use as medicaments. BAYER AG (DE) 1979-02-07 EP 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 (3 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-20210221805-A1 SIGMA-2 RECEPTOR LIGAND DRUG CONJUGATES AS ANTITUMOR COMPOUNDS, METHODS OF SYNTHESIS AND USES THEREOF SIGMAR1, TMEM97, AIFM2 ALDH1A1 1104/4885KMT2A 3212/4885MEN1 3626/4885
US-11407767-B2 Heterocyclyl substituted pyrrolopyridines that are inhibitors of the CDK12 kinase CDK1, CDK11A, CDK12 ALDH1A1 4568/4885KMT2A 454/4885MEN1 1864/4885
US-20250145617-A1 SIGMA-2 RECEPTOR LIGAND DRUG CONJUGATES AS ANTITUMOR COMPOUNDS, METHODS OF SYNTHESIS AND USES THEREOF SIGMAR1, TMEM97, AIFM2 ALDH1A1 1104/4885KMT2A 3212/4885MEN1 3626/4885

“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.