SCHEMBL9721289

SCHEMBL9721289

Cc1ccc(-c2c(C=O)c(C=O)c(O)c3cc(C)ccc23)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALB P02768 2/20 0.49
▸ AR P10275 4/20 0.42
▸ MAOB P27338 1/20 0.37
▸ LDHA P00338 2/20 0.36
▸ LDHB P07195 2/20 0.36
▸ ALPG P10696 1/20 0.36
▸ ERN1 O75460 3/20 0.36
▸ TP53 P04637 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ CSNK2A2 P19784 1/20 0.36
▸ CSNK2B P67870 1/20 0.36
▸ CSNK2A1 P68400 1/20 0.36
▸ PADI4 Q9UM07 1/20 0.36
▸ CA12 O43570 1/20 0.35
▸ CA9 Q16790 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ AKR1C2 P52895 1/20 0.35
▸ AKR1C1 Q04828 1/20 0.35
▸ GRM2 Q14416 1/20 0.35
▸ DHODH Q02127 1/20 0.35

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
SCHEMBL9721276 0.81 ESR1 (0.44) ARMAOBERN1TP53MAPT
SCHEMBL9721255 0.75 ERN1 (0.39) ALBARLDHALDHBERN1
SCHEMBL9721231 0.75 SENP1 (0.44) ALBMAOBLDHALDHBTP53
SCHEMBL9721301 0.73 ERN1 (0.47) ALBLDHALDHBERN1CA12
SCHEMBL9721314 0.72 ERN1 (0.39) ALBARLDHALDHBERN1
SCHEMBL9721316 0.72 ERN1 (0.39) ALBARLDHALDHBERN1
SCHEMBL17166195 0.71 CYP2A6 (0.59) ALBMAOBALPGMAPTALDH1A1
SCHEMBL9721353 0.71 PADI4 (0.60) ARERN1MAPTPADI4ALDH1A1
SCHEMBL9721268 0.71 NOX4 (0.42) ERN1TP53MAPTCSNK2A2CSNK2B
SCHEMBL17166196 0.69 CYP2A6 (0.56) ALBALPGMAPTALDH1A1

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
US-5112869-A SUBSTITUTED 1-PHENYLNAPHTHALENES SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) 1992-05-12 — — US claimed
US-5112869-A SUBSTITUTED 1-PHENYLNAPHTHALENES SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) 1992-05-12 — — US disclosed
WO-1990011988-A1 SUBSTITUTED 1-PHENYLNAPHTHALENES SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) 1990-10-18 — — WO disclosed
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