SCHEMBL92052

SCHEMBL92052

COc1cc(Cl)c(OC)cc1C

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.52
NPC1 O15118 1/20 0.52
TAAR1 Q96RJ0 2/20 0.48
ALDH1A1 P00352 3/20 0.46
HSP90AA1 P07900 1/20 0.46
MAPT P10636 1/20 0.46
PKM P14618 1/20 0.46
MAPK1 P28482 1/20 0.46
RAB9A P51151 1/20 0.46
CCR6 P51684 1/20 0.46
CACNA1B Q00975 1/20 0.46
APBA1 Q02410 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
APOBEC3G Q9HC16 1/20 0.46
GLA P06280 1/20 0.43
TSHR P16473 1/20 0.43
LMNA P02545 1/20 0.42
HTT P42858 1/20 0.42
ACHE P22303 2/20 0.42
MEN1 O00255 1/20 0.42

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
SCHEMBL91989 0.90 GAA (0.58) GAANPC1TAAR1ALDH1A1HSP90AA1
SCHEMBL383766 0.87 GAA (0.54) GAANPC1TAAR1ALDH1A1HSP90AA1
SCHEMBL12706044 0.87 GAA (0.43) GAANPC1TAAR1ALDH1A1HSP90AA1
Chloroneb SCHEMBL22739 0.87 GAA (0.64) GAANPC1TAAR1ALDH1A1HSP90AA1
SCHEMBL3754009 0.85 GLA (0.52) GAANPC1TAAR1ALDH1A1MAPT
SCHEMBL1755249 0.85 NPC1 (0.58) GAANPC1TAAR1ALDH1A1HSP90AA1
SCHEMBL92053 0.85 KMT2A (0.47) GAANPC1TAAR1ALDH1A1MAPT
SCHEMBL5633315 0.85 GAA (0.39) GAANPC1TAAR1ALDH1A1HSP90AA1
SCHEMBL2954181 0.84 TAAR1 (0.56) GAATAAR1ALDH1A1MAPTGLA
SCHEMBL29587813 0.82 GLA (0.53) GAANPC1TAAR1ALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11760762-B2 Thienopyranones and furanopyranones as kinase, bromodomain, and checkpoint inhibitors SIGNALRX PHARMACEUTICALS, INC. (US) 2023-09-19 US disclosed
US-9169182-B2 Chrysophaentin analogs that inhibit FtsZ protein THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2015-10-27 US disclosed
US-9169182-B2 Chrysophaentin analogs that inhibit FtsZ protein THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2015-10-27 US disclosed
US-20130331460-A1 CHRYSOPHAENTIN ANALOGS THAT INHIBIT FTSZ PROTEIN UNIVERSITY OF PITTSBURGH OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2013-12-12 US disclosed
US-20130331460-A1 CHRYSOPHAENTIN ANALOGS THAT INHIBIT FTSZ PROTEIN UNIVERSITY OF PITTSBURGH OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2013-12-12 US disclosed
EP-2146230-B1 Binary diketopyrrolopyrrole pigment compound for use in colour filters CLARIANT FINANCE BVI LTD (VG) 2012-09-12 EP disclosed
WO-2012116254-A2 CHRYSOPHAENTIN ANALOGS THAT INHIBIT FTSZ PROTEIN THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2012-08-30 WO disclosed
US-8236965-B2 Benzimidazole derivatives and their use as a medicament IPSEN PHARMA S.A.S. (FR) 2012-08-07 US disclosed
EP-2145926-B1 PR 254 pigment preparation for use in colour filters CLARIANT FINANCE BVI LTD (VG) 2012-05-30 EP disclosed
US-8128848-B2 Diketopyrrolopyrrole pigment composition for use in color filters CLARIANT FINANCE (BVI) LIMITED (VG) 2012-03-06 US disclosed
EP-1562589-B1 DIAMINOTRIAZOLES USEFUL AS INHIBITORS OF PROTEIN KINASES VERTEX PHARMA (US) 2009-01-07 EP disclosed
US-20080014189-A1 DIAMINOTRIAZOLES USEFUL AS INHIBITORS OF PROTEIN KINASES VERTEX PHARMACEUTICALS INCORPORATED 2008-01-17 US disclosed
US-20080014189-A1 DIAMINOTRIAZOLES USEFUL AS INHIBITORS OF PROTEIN KINASES VERTEX PHARMACEUTICALS INCORPORATED 2008-01-17 US disclosed
US-7279469-B2 Diaminotriazoles useful as inhibitors of protein kinases VERTEX PHARMACEUTICALS INCORPORATED (US) 2007-10-09 US disclosed
US-7279469-B2 Diaminotriazoles useful as inhibitors of protein kinases VERTEX PHARMACEUTICALS INCORPORATED (US) 2007-10-09 US disclosed
US-20070129364-A1 Pyrrolopyridine kinase inhibiting compounds OSI PHARMACEUTICALS, INC. 2007-06-07 US disclosed
US-20070129364-A1 Pyrrolopyridine kinase inhibiting compounds OSI PHARMACEUTICALS, INC. 2007-06-07 US disclosed
US-7220765-B2 Derivatives of 2-arylimino-2,3-dihydrothiazoles, their preparation processes and their therapeutic use SOCIETE DE CONSEILS DE RECHERCHES ET D'APPLICATIONS SCIENTIFIQUES (SCRAS) (FR) 2007-05-22 US disclosed
WO-2005007621-A2 UBIQUITIN LIGASE INHIBITORS RIGEL PHARMACEUTICALS, INC. (US) 2005-01-27 WO disclosed
US-4975463-A VIRICIDES; AIDS TREATMENT TEMPLE UNIVERSITY OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 1990-12-04 US 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 (4 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-11760762-B2 Thienopyranones and furanopyranones as kinase, bromodomain, and checkpoint inhibitors CDK1, CDKN1A, CDKL1 GAA 4060/4885NPC1 3001/4885TAAR1 1547/4885
US-20080014189-A1 DIAMINOTRIAZOLES USEFUL AS INHIBITORS OF PROTEIN KINASES MAP3K20, MAP3K1, MAP3K5 GAA 1264/4885NPC1 2770/4885TAAR1 2746/4885
US-20070129364-A1 Pyrrolopyridine kinase inhibiting compounds BMX, ERBB2, FRK GAA 3064/4885NPC1 4182/4885TAAR1 2970/4885
US-20130331460-A1 CHRYSOPHAENTIN ANALOGS THAT INHIBIT FTSZ PROTEIN CDC42, CEP170, FNTA GAA 1566/4885NPC1 2324/4885TAAR1 4818/4885

“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.