SCHEMBL9766862

SCHEMBL9766862

O=c1c(-c2ccc(Cl)cc2)c1-c1ccc(Cl)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.52
MAPT P10636 3/20 0.52
HTT P42858 1/20 0.52
CYP2A6 P11509 1/20 0.47
CYP1A2 P05177 1/20 0.46
CA1 P00915 3/20 0.44
CA2 P00918 3/20 0.44
CA12 O43570 1/20 0.44
CA3 P07451 1/20 0.44
CA4 P22748 1/20 0.44
CA6 P23280 1/20 0.44
CA5A P35218 1/20 0.44
CA7 P43166 1/20 0.44
CA9 Q16790 1/20 0.44
CA13 Q8N1Q1 1/20 0.44
CA14 Q9ULX7 1/20 0.44
CA5B Q9Y2D0 1/20 0.44
GAA P10253 3/20 0.43
ALDH1A1 P00352 2/20 0.43
THRB P10828 2/20 0.43

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
SCHEMBL11223011 0.81 LMNA (0.61) LMNAMAPTCYP2A6CYP1A2ALDH1A1
SCHEMBL3561082 0.76 MAPT (0.48) LMNAMAPTCYP2A6CYP1A2GAA
SCHEMBL3952742 0.73 CYP1A2 (0.73) LMNACYP2A6CYP1A2ALDH1A1TSHR
SCHEMBL11165087 0.73 CYP1A2 (0.73) LMNACYP2A6CYP1A2ALDH1A1TSHR
SCHEMBL28215 0.73 CYP1A2 (0.73) LMNACYP2A6CYP1A2ALDH1A1TSHR
SCHEMBL4458316 0.73 LMNA (0.50) LMNAMAPTCYP2A6CYP1A2CA1
SCHEMBL28631682 0.71 CYP1A2 (0.61) LMNAMAPTCYP2A6CYP1A2GAA
Formaldehyde SCHEMBL27996758 0.71 CYP1A2 (0.61) LMNAMAPTCYP2A6CYP1A2GAA
SCHEMBL25392161 0.71 MAPT (0.52) LMNAMAPTHTTCYP2A6CA1
SCHEMBL3561069 0.71 LMNA (0.47) LMNAMAPTCYP2A6CYP1A2GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119307056-A Mildew-proof antibacterial PVC printing film and preparation method thereof 南通吉美装饰材料有限公司 2025-01-14 CN claimed
US-4985464-A Drug compositions for local treatment of alopecia areata HAPPLE RUDOLF (DE) 1991-01-15 US claimed
CN-119307056-A Mildew-proof antibacterial PVC printing film and preparation method thereof 南通吉美装饰材料有限公司 2025-01-14 CN disclosed