SCHEMBL10462015

SCHEMBL10462015

CCCCCCCc1ccc(-c2ccc(-c3ccc(CCCCCC)nc3)cc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.56
HSD17B10 Q99714 3/20 0.56
ALDH1A1 P00352 3/20 0.56
RAB9A P51151 3/20 0.56
MEN1 O00255 2/20 0.56
KMT2A Q03164 2/20 0.56
SMN1; SMN2 Q16637 2/20 0.56
KDM4E B2RXH2 2/20 0.56
USP2 O75604 1/20 0.56
GAA P10253 1/20 0.56
HPGD P15428 1/20 0.56
TSHR P16473 1/20 0.53
RARB P10826 6/20 0.51
RARA P10276 1/20 0.51
MTOR P42345 1/20 0.51
NPC1 O15118 1/20 0.50
STAT3 P40763 1/20 0.50
ATM Q13315 1/20 0.50
ESR1 P03372 2/20 0.49
ADRA2A P08913 2/20 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
SCHEMBL10462934 1.00 MAPT (0.56) MAPTHSD17B10ALDH1A1RAB9AMEN1
SCHEMBL10461203 1.00 MAPT (0.56) MAPTHSD17B10ALDH1A1RAB9AMEN1
SCHEMBL10462510 1.00 MAPT (0.56) MAPTHSD17B10ALDH1A1RAB9AMEN1
SCHEMBL10460929 1.00 MAPT (0.56) MAPTHSD17B10ALDH1A1RAB9AMEN1
SCHEMBL10462330 1.00 MAPT (0.56) MAPTHSD17B10ALDH1A1RAB9AMEN1
SCHEMBL10462501 1.00 MAPT (0.56) MAPTHSD17B10ALDH1A1RAB9AMEN1
SCHEMBL10461041 1.00 MAPT (0.56) MAPTHSD17B10ALDH1A1RAB9AMEN1
SCHEMBL10462220 1.00 MAPT (0.56) MAPTHSD17B10ALDH1A1RAB9AMEN1
SCHEMBL10462486 1.00 MAPT (0.56) MAPTHSD17B10ALDH1A1RAB9AMEN1
SCHEMBL10461294 1.00 MAPT (0.56) MAPTHSD17B10ALDH1A1RAB9AMEN1

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-4913837-A Heterocyclic compounds MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1990-04-03 US disclosed