SCHEMBL3972232

SCHEMBL3972232

O=C1/C(=N/O)Cc2cc(Br)ccc21

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.59
CYP1A2 P05177 1/20 0.59
CYP2C19 P33261 1/20 0.59
METAP1 P53582 1/20 0.57
TDP2 O95551 1/20 0.47
TDP1 Q9NUW8 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
S100A4 P26447 1/20 0.42
MAOA P21397 2/20 0.42
MAOB P27338 2/20 0.42
BCL2 P10415 2/20 0.41
MCL1 Q07820 1/20 0.41
PARP10 Q53GL7 2/20 0.40
PARP11 Q9NR21 1/20 0.40
SRD5A1 P18405 1/20 0.39
SRD5A2 P31213 1/20 0.39
CMA1 P23946 1/20 0.39
AHR P35869 1/20 0.39
PTPRC P08575 1/20 0.38
CA1 P00915 2/20 0.37

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
SCHEMBL3972234 1.00 ALDH1A1 (0.59) ALDH1A1CYP1A2CYP2C19METAP1TDP2
SCHEMBL13716800 1.00 ALDH1A1 (0.59) ALDH1A1CYP1A2CYP2C19METAP1TDP2
SCHEMBL13717080 0.90 ALDH1A1 (0.59) ALDH1A1CYP1A2CYP2C19METAP1TDP2
SCHEMBL3965519 0.90 ALDH1A1 (0.59) ALDH1A1CYP1A2CYP2C19METAP1TDP2
SCHEMBL3965520 0.90 ALDH1A1 (0.59) ALDH1A1CYP1A2CYP2C19METAP1TDP2
SCHEMBL10144900 0.82 METAP1 (0.45) ALDH1A1CYP1A2CYP2C19METAP1TDP2
SCHEMBL571311 0.82 METAP1 (0.45) ALDH1A1CYP1A2CYP2C19METAP1TDP2
SCHEMBL10182356 0.82 METAP1 (0.45) ALDH1A1CYP1A2CYP2C19METAP1TDP2
SCHEMBL571312 0.82 METAP1 (0.45) ALDH1A1CYP1A2CYP2C19METAP1TDP2
SCHEMBL10182213 0.81 METAP1 (0.44) ALDH1A1CYP1A2CYP2C19METAP1TDP2

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4739683-A1 1,6-NAPHTHRIDINE COMPOUNDS AS SMARCA2 INHIBITORS USEFUL FOR THE TREATMENT OF SMARCA4 DEFICIENT CANCERS Janssen Pharmaceutica NV (BE) 2026-05-13 EP disclosed
WO-2025008059-A1 1,6-NAPHTHRIDINE COMPOUNDS AS SMARCA2 INHIBITORS USEFUL FOR THE TREATMENT OF SMARCA4 DEFICIENT CANCERS JANSSEN PHARMACEUTICA NV (BE) 2025-01-09 WO disclosed
US-9698356-B2 Heteroaryl-based compound and organic light-emitting diode including the same SAMSUNG DISPLAY CO., LTD. (KR) 2017-07-04 US disclosed
US-20140306186-A1 HETEROARYL-BASED COMPOUND AND ORGANIC LIGHT-EMITTING DIODE INCLUDING THE SAME SAMSUNG DISPLAY CO., LTD. (KR) 2014-10-16 US disclosed
WO-2014089324-A1 SUBSTITUTED CYCLIC COMPOUNDS AND METHODS OF USE CALITOR SCIENCES, LLC (US) 2014-06-12 WO disclosed
US-7572809-B2 Isoquinoline aminopyrazole derivatives HOFFMANN-LA ROCHE INC. (US) 2009-08-11 US disclosed
EP-1966190-A1 ISOQUINOLINE AMINOPYRAZOLE DERIVATIVES, THEIR MANUFACTURE AND USE AS PHARMACEUTICAL AGENTS FOR THE TREATMENT OF CANCER F.HOFFMANN-LA ROCHE AG (CH) 2008-09-10 EP disclosed
US-20070179151-A1 Isoquinoline aminopyrazole derivatives F. HOFMANN-LA ROCHE AG (CH) 2007-08-02 US disclosed
WO-2007071348-A1 ISOQUINOLINE AMINOPYRAZOLE DERIVATIVES, THEIR MANUFACTURE AND USE AS PHARMACEUTICAL AGENTS FOR THE TREATMENT OF CANCER F. HOFFMANN-LA ROCHE AG (CH) 2007-06-28 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 (1 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-20070179151-A1 Isoquinoline aminopyrazole derivatives CYP3A5, CYP3A43, CYP3A4 ALDH1A1 198/4885CYP1A2 9/4885CYP2C19 17/4885

“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.