SCHEMBL8154848

SCHEMBL8154848

O=C(Nc1cccc2c(NC(=O)Oc3ccccc3)cccc12)Oc1ccccc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TRPV1 Q8NER1 1/20 0.66
▸ RAB9A P51151 2/20 0.58
▸ NPSR1 Q6W5P4 2/20 0.58
▸ NPC1 O15118 1/20 0.58
▸ KMT2A Q03164 5/20 0.55
▸ MEN1 O00255 2/20 0.55
▸ ALDH1A1 P00352 8/20 0.53
▸ MAPT P10636 3/20 0.53
▸ CYP1A2 P05177 3/20 0.53
▸ RAD51 Q06609 1/20 0.51
▸ KDM4E B2RXH2 4/20 0.50
▸ HPGD P15428 3/20 0.50
▸ GAA P10253 2/20 0.50
▸ GLA P06280 1/20 0.50
▸ ATM Q13315 1/20 0.50
▸ MAOB P27338 1/20 0.50
▸ THRB P10828 1/20 0.49
▸ GFER P55789 1/20 0.49
▸ TDP1 Q9NUW8 1/20 0.49
▸ HTT P42858 1/20 0.49

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
SCHEMBL1312094 0.91 TRPV1 (0.74) TRPV1RAB9ANPSR1NPC1KMT2A
SCHEMBL619666 0.85 PARP1 (0.65) TRPV1KMT2AALDH1A1CYP1A2HSD17B10
SCHEMBL1735617 0.84 TRPV1 (0.51) TRPV1RAB9ANPSR1NPC1KMT2A
SCHEMBL3201877 0.84 TRPV1 (0.51) TRPV1RAB9ANPSR1NPC1KMT2A
SCHEMBL11076373 0.84 KMT2A (0.58) TRPV1RAB9ANPSR1NPC1KMT2A
SCHEMBL3144214 0.83 MEN1 (0.61) TRPV1RAB9AKMT2AMEN1ALDH1A1
SCHEMBL1641651 0.81 KMT2A (0.55) TRPV1RAB9ANPSR1NPC1KMT2A
SCHEMBL28731979 0.81 TRPV1 (0.61) TRPV1RAB9ANPSR1NPC1KMT2A
SCHEMBL17942780 0.81 MAOB (0.54) TRPV1RAB9ANPSR1NPC1KMT2A
SCHEMBL3582762 0.80 TRPV1 (1.00) TRPV1RAB9AKMT2AMEN1MAPT

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-2000344730-A PRODUCTION OF 1,5-NAPHTHALENEDIISOCYANATE MITSUBISHI GAS CHEM CO INC 2000-12-12 — — JP disclosed
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