SCHEMBL11655195

SCHEMBL11655195

CCCCCOc1ccc(C=C(C#N)c2ccc(C)cc2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.54
▸ GAA P10253 3/20 0.54
▸ HPGD P15428 2/20 0.54
▸ MEN1 O00255 1/20 0.54
▸ KMT2A Q03164 1/20 0.54
▸ KDM4E B2RXH2 1/20 0.48
▸ ESR1 P03372 2/20 0.47
▸ ESR2 Q92731 2/20 0.47
▸ NQO2 P16083 2/20 0.46
▸ TP53 P04637 2/20 0.46
▸ TSHR P16473 1/20 0.46
▸ PLA2G4B P0C869 1/20 0.45
▸ NR5A1 Q13285 1/20 0.43
▸ RARB P10826 3/20 0.43
▸ MAPT P10636 2/20 0.43
▸ NPC1 O15118 1/20 0.43
▸ LMNA P02545 1/20 0.43
▸ ALOX15 P16050 1/20 0.43
▸ RAB9A P51151 1/20 0.43
▸ HSD17B10 Q99714 1/20 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
SCHEMBL11356097 0.99 ALDH1A1 (0.53) ALDH1A1GAAHPGDMEN1KMT2A
SCHEMBL11686794 0.99 ALDH1A1 (0.53) ALDH1A1GAAHPGDMEN1KMT2A
SCHEMBL11332817 0.95 ALDH1A1 (0.52) ALDH1A1GAAHPGDMEN1KMT2A
SCHEMBL11332814 0.95 ALDH1A1 (0.52) ALDH1A1GAAHPGDMEN1KMT2A
SCHEMBL11659439 0.93 TP53 (0.52) ALDH1A1GAAHPGDKDM4EESR1
SCHEMBL11656786 0.93 TP53 (0.52) ALDH1A1GAAHPGDKDM4EESR1
SCHEMBL11660429 0.93 TP53 (0.52) ALDH1A1GAAHPGDKDM4EESR1
SCHEMBL20156660 0.92 ALDH1A1 (0.54) ALDH1A1GAAHPGDMEN1KMT2A
SCHEMBL10635627 0.90 TP53 (0.49) ALDH1A1GAAHPGDKDM4EESR1
SCHEMBL11656013 0.90 TP53 (0.49) ALDH1A1GAAHPGDKDM4EESR1

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-4107189-A 2,3-DIPHENYLACRYLONITRILES, DYNAMIC SCATTERING IN ELECTRICAL FIELD U.S. PHILIPS CORPORATION (US) 1978-08-15 — — US disclosed
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