SCHEMBL11870828

SCHEMBL11870828

Cc1ccc(CC=C(C=O)c2ccc(C)cc2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SRD5A2 P31213 1/20 0.40
▸ ALDH1A1 P00352 6/20 0.39
▸ KMT2A Q03164 3/20 0.39
▸ PKM P14618 2/20 0.39
▸ HTT P42858 2/20 0.39
▸ ATM Q13315 2/20 0.39
▸ NPSR1 Q6W5P4 2/20 0.39
▸ LMNA P02545 2/20 0.39
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ MEN1 O00255 2/20 0.39
▸ HPGD P15428 1/20 0.39
▸ NLRP1 Q9C000 1/20 0.39
▸ NTSR1 P30989 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ CES2 O00748 1/20 0.39
▸ CES1 P23141 1/20 0.39
▸ NPC1 O15118 3/20 0.39
▸ RAB9A P51151 3/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ MAPT P10636 1/20 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
SCHEMBL11870822 1.00 SRD5A2 (0.40) SRD5A2ALDH1A1KMT2APKMHTT
SCHEMBL28223848 0.91 GPR52 (0.44) ALDH1A1KMT2AHTTLMNASMN1; SMN2
SCHEMBL28810004 0.91 NPC1 (0.43) ALDH1A1KMT2ALMNASMN1; SMN2MEN1
SCHEMBL27525653 0.89 SMN1; SMN2 (0.46) ALDH1A1KMT2AHTTLMNASMN1; SMN2
SCHEMBL26203486 0.85 LMNA (0.54) SRD5A2ALDH1A1KMT2APKMLMNA
SCHEMBL28601859 0.85 SMN1; SMN2 (0.39) ALDH1A1HTTLMNASMN1; SMN2HPGD
SCHEMBL6784264 0.83 NQO2 (0.49) KMT2APKMHTTLMNAMEN1
SCHEMBL6784267 0.83 NQO2 (0.49) KMT2APKMHTTLMNAMEN1
SCHEMBL27930015 0.79 TRPA1 (0.40) SRD5A2ALDH1A1PKMHTTATM
SCHEMBL27416875 0.77 TSHR (0.47) SRD5A2ALDH1A1LMNAHPGDTDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-3948991-A Cyclic aldol condensation process and catalyst regeneration procedure GULF RESEARCH & DEVELOPMENT COMPANY (US) 1976-04-06 — — US disclosed
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