SCHEMBL11241566

SCHEMBL11241566

Cc1ccccc1C(=O)NC(=O)Nc1ccc(OCc2cccs2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 6/20 0.51
▸ SMN1; SMN2 Q16637 3/20 0.51
▸ THRB P10828 1/20 0.51
▸ RAB9A P51151 7/20 0.48
▸ NPC1 O15118 6/20 0.48
▸ KIT P10721 2/20 0.48
▸ PDGFRA P16234 2/20 0.48
▸ MEN1 O00255 2/20 0.47
▸ KMT2A Q03164 2/20 0.47
▸ GAA P10253 2/20 0.46
▸ TP53 P04637 2/20 0.46
▸ LMNA P02545 2/20 0.46
▸ ALDH1A1 P00352 2/20 0.45
▸ ALOX12 P18054 1/20 0.45
▸ NPSR1 Q6W5P4 1/20 0.45
▸ CYP1A2 P05177 1/20 0.44
▸ CYP2C9 P11712 1/20 0.44
▸ CYP2C19 P33261 1/20 0.44
▸ RXFP1 Q9HBX9 1/20 0.44
▸ POLB P06746 1/20 0.44

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
SCHEMBL11236412 0.87 TDP1 (0.57) MAPTSMN1; SMN2RAB9ANPC1MEN1
SCHEMBL11233908 0.84 PNLIP (0.49) MAPTSMN1; SMN2THRBRAB9ANPC1
SCHEMBL11247202 0.80 SMN1; SMN2 (0.51) MAPTSMN1; SMN2THRBRAB9ANPC1
SCHEMBL11240981 0.79 RAB9A (0.46) MAPTSMN1; SMN2THRBRAB9ANPC1
SCHEMBL11383034 0.79 ALDH1A1 (0.59) MAPTSMN1; SMN2RAB9ANPC1KIT
SCHEMBL11246280 0.75 NPC1 (0.49) MAPTSMN1; SMN2RAB9ANPC1KIT
SCHEMBL11133147 0.74 TDP1 (0.57) MAPTSMN1; SMN2THRBRAB9ANPC1
SCHEMBL28196235 0.74 HPGD (0.74) MAPTSMN1; SMN2THRBRAB9ANPC1
SCHEMBL11247921 0.74 GCGR (0.59) MAPTSMN1; SMN2RAB9ANPC1MEN1
SCHEMBL11393574 0.74 FFAR1 (0.51) MAPTSMN1; SMN2RAB9ANPC1KIT

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-4350706-A MITICIDES, LARVICIDES DUPHAR INTERNATIONAL RESEARCH B.V. (NL) 1982-09-21 — — US disclosed
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