SCHEMBL10340522

SCHEMBL10340522

CCCCCCCCc1ccc(C(OC(c2ccc(CCCCCCCC)cc2)c2cnc(-c3ccc(CCCCC)cc3)nc2)c2cnc(-c3ccc(CCCCC)cc3)nc2)cc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.62
RAB9A P51151 3/20 0.62
ALDH1A1 P00352 3/20 0.62
HSD17B10 Q99714 3/20 0.62
MEN1 O00255 2/20 0.62
KMT2A Q03164 2/20 0.62
SMN1; SMN2 Q16637 2/20 0.62
KDM4E B2RXH2 2/20 0.62
USP2 O75604 1/20 0.62
GAA P10253 1/20 0.62
HPGD P15428 1/20 0.62
RARB P10826 6/20 0.51
S1PR4 O95977 3/20 0.44
S1PR1 P21453 3/20 0.44
S1PR5 Q9H228 3/20 0.44
RARA P10276 1/20 0.43
MTOR P42345 1/20 0.43
NPC1 O15118 1/20 0.43
STAT3 P40763 1/20 0.43
ATM Q13315 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
SCHEMBL10340352 1.00 MAPT (0.62) MAPTRAB9AALDH1A1HSD17B10MEN1
SCHEMBL9436028 0.95 MAPT (0.62) MAPTRAB9AALDH1A1HSD17B10MEN1
SCHEMBL9435521 0.95 MAPT (0.62) MAPTRAB9AALDH1A1HSD17B10MEN1
SCHEMBL9435692 0.95 MAPT (0.62) MAPTRAB9AALDH1A1HSD17B10MEN1
SCHEMBL9436033 0.95 MAPT (0.62) MAPTRAB9AALDH1A1HSD17B10MEN1
SCHEMBL10340674 0.95 MAPT (0.62) MAPTRAB9AALDH1A1HSD17B10MEN1
SCHEMBL9436300 0.95 MAPT (0.62) MAPTRAB9AALDH1A1HSD17B10MEN1
SCHEMBL9436014 0.95 MAPT (0.62) MAPTRAB9AALDH1A1HSD17B10MEN1
SCHEMBL9435967 0.95 MAPT (0.62) MAPTRAB9AALDH1A1HSD17B10MEN1
SCHEMBL9436058 0.95 MAPT (0.62) MAPTRAB9AALDH1A1HSD17B10MEN1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0224579-B1 SMECTIC LIQUID CRYSTALLINE PHASES MERCK PATENT GmbH (DE) 1990-01-24 EP disclosed
EP-0224579-A1 SMECTIC LIQUID CRYSTALLINE PHASES. MERCK PATENT GMBH (DE) 1987-06-10 EP disclosed
WO-1986007085-A1 SMECTIC LIQUID CRYSTALLINE PHASES MERCK Patent Gesellschaft mit beschränkter Haftung (DE) 1986-12-04 WO disclosed