SCHEMBL9709050

SCHEMBL9709050

O=c1c2ccccc2[nH]c2cc(Br)ccc12

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 3/20 0.67
HTT P42858 3/20 0.67
KDM4E B2RXH2 2/20 0.67
ALDH1A1 P00352 2/20 0.67
GLA P06280 2/20 0.67
LMNA P02545 2/20 0.67
SMN1; SMN2 Q16637 2/20 0.67
HPGD P15428 1/20 0.67
ATM Q13315 1/20 0.67
CCNB2 O95067 3/20 0.59
CDK1 P06493 3/20 0.59
CCNB1 P14635 3/20 0.59
CCNB3 Q8WWL7 3/20 0.59
CDK5 Q00535 2/20 0.59
CDK5R1 Q15078 2/20 0.59
CCNE2 O96020 2/20 0.59
CDK4 P11802 2/20 0.59
CCND1 P24385 2/20 0.59
CCNE1 P24864 2/20 0.59
CDK2 P24941 2/20 0.59

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
SCHEMBL3854826 0.89 ALDH1A1 (0.67) GAAHTTKDM4EALDH1A1GLA
SCHEMBL30982031 0.89 ALDH1A1 (0.67) GAAHTTKDM4EALDH1A1GLA
SCHEMBL25294 0.88 AHR (0.64) ALDH1A1LMNASMN1; SMN2CCNB2CDK1
SCHEMBL30286037 0.88 AHR (0.64) ALDH1A1LMNASMN1; SMN2CCNB2CDK1
SCHEMBL29814236 0.88 AHR (0.64) ALDH1A1LMNASMN1; SMN2CCNB2CDK1
SCHEMBL10171024 0.87 HSD17B10 (0.53) GAAHTTKDM4EALDH1A1GLA
SCHEMBL13412901 0.82 GAA (0.82) GAAHTTKDM4EALDH1A1GLA
SCHEMBL92077 0.82 GAA (0.82) GAAHTTKDM4EALDH1A1GLA
SCHEMBL22367061 0.82 GAA (0.82) GAAHTTKDM4EALDH1A1GLA
SCHEMBL29349876 0.82 GAA (0.82) GAAHTTKDM4EALDH1A1GLA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4629980-A1 ANTIMICROBIAL COMPOUNDS SRI International (US) 2025-10-15 EP disclosed
WO-2024123663-A1 ANTIMICROBIAL COMPOUNDS SRI INTERNATIONAL (US) 2024-06-13 WO disclosed
US-9899604-B2 Compound for organic optoelectronic device, organic light emitting diode including the same, and display including the organic light emitting diode SAMSUNG ELECTRONICS CO., LTD. (KR) 2018-02-20 US disclosed
US-20140225083-A1 COMPOUND FOR ORGANIC OPTOELECTRONIC DEVICE, ORGANIC LIGHT EMITTING DIODE INCLUDING THE SAME, AND DISPLAY INCLUDING THE ORGANIC LIGHT EMITTING DIODE CHEIL INDUSTRIES INC. (KR) 2014-08-14 US disclosed
US-20140225083-A1 COMPOUND FOR ORGANIC OPTOELECTRONIC DEVICE, ORGANIC LIGHT EMITTING DIODE INCLUDING THE SAME, AND DISPLAY INCLUDING THE ORGANIC LIGHT EMITTING DIODE CHEIL INDUSTRIES INC. (KR) 2014-08-14 US disclosed
EP-0471516-A1 Tricyclic heterocyclic derivatives IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1992-02-19 EP disclosed