SCHEMBL6422123

SCHEMBL6422123

Nc1ccccc1/C=C/c1ccc2c(ccc3ccccc32)c1/C=C/c1ccccc1N

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HPRT1 P00492 3/20 0.47
▸ ALDH1A1 P00352 4/20 0.41
▸ HSD17B10 Q99714 3/20 0.41
▸ CYP3A4 P08684 3/20 0.41
▸ TSHR P16473 2/20 0.41
▸ HPGD P15428 1/20 0.41
▸ KEAP1 Q14145 1/20 0.41
▸ TDP1 Q9NUW8 2/20 0.39
▸ CYP2A6 P11509 1/20 0.39
▸ SUMO2 P61956 1/20 0.37
▸ SUMO1 P63165 1/20 0.37
▸ SENP7 Q9BQF6 1/20 0.37
▸ SENP3 Q9H4L4 1/20 0.37
▸ SENP2 Q9HC62 1/20 0.37
▸ SENP1 Q9P0U3 1/20 0.37
▸ MAPT P10636 2/20 0.37
▸ LMNA P02545 1/20 0.37
▸ APEX1 P27695 1/20 0.37
▸ MAPK1 P28482 1/20 0.37
▸ PMP22 Q01453 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
SCHEMBL1054288 0.92 ALDH1A1 (0.45) HPRT1ALDH1A1HSD17B10CYP3A4TSHR
SCHEMBL6422555 0.85 HPRT1 (0.52) HPRT1ALDH1A1HSD17B10CYP3A4TSHR
SCHEMBL4947905 0.81 ALDH1A1 (0.38) HPRT1ALDH1A1HSD17B10CYP3A4TSHR
SCHEMBL22634151 0.80 HPRT1 (0.48) HPRT1ALDH1A1HSD17B10CYP3A4TSHR
SCHEMBL22634150 0.80 HPRT1 (0.48) HPRT1ALDH1A1HSD17B10CYP3A4TSHR
SCHEMBL3932039 0.77 ALDH1A1 (0.58) ALDH1A1HSD17B10CYP3A4TSHRHPGD
SCHEMBL22288140 0.73 HPRT1 (0.64) HPRT1ALDH1A1HSD17B10TSHRHPGD
SCHEMBL10890521 0.72 CYP19A1 (0.50) SENP7MAPTCHATMEN1KMT2A
SCHEMBL6422560 0.72 HPRT1 (0.49) HPRT1ALDH1A1HSD17B10CYP3A4TSHR
SCHEMBL10890524 0.72 CYP19A1 (0.50) SENP7MAPTCHATMEN1KMT2A

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
JP-2005035927-A BIS(AMINOSTYRYL)PHENANTHRENE COMPOUND AND INTERMEDIATE FOR SYNTHESIZING THE SAME, AND METHODS FOR PRODUCING THEM SONY CORP 2005-02-10 — — JP disclosed
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