SCHEMBL6564321

SCHEMBL6564321

CCC1(c2cccs2)OCCO1

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.39
TSHR P16473 1/20 0.39
SLC6A2 P23975 2/20 0.39
TP53 P04637 1/20 0.38
ICMT O60725 1/20 0.37
SLC6A3 Q01959 1/20 0.37
OPRM1 P35372 1/20 0.37
OPRL1 P41146 1/20 0.37
SLC6A4 P31645 2/20 0.35
MEN1 O00255 1/20 0.34
PRCP P42785 1/20 0.34
KMT2A Q03164 1/20 0.34
SIGMAR1 Q99720 1/20 0.34

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
SCHEMBL11543881 0.81 SLC6A2 (0.39) LMNASLC6A2TP53ICMTSLC6A3
SCHEMBL754463 0.76 SLC6A3 (0.41) LMNASLC6A2ICMTSLC6A3OPRM1
SCHEMBL2208999 0.76 SLC6A2 (0.35) SLC6A2TP53ICMTSLC6A3OPRM1
SCHEMBL10779269 0.74 ICMT (0.33) SLC6A2ICMTSLC6A3SLC6A4MEN1
SCHEMBL28983665 0.71 ICMT (0.46) LMNATSHRSLC6A2TP53ICMT
SCHEMBL10779346 0.70 HSD17B10 (0.39) LMNATSHRTP53MEN1KMT2A
SCHEMBL11548284 0.70 HSP90AA1 (0.39) MEN1PRCPKMT2ASIGMAR1
SCHEMBL27487819 0.69
SCHEMBL10783718 0.69 USP2 (0.35) LMNATSHRTP53
SCHEMBL14779113 0.68 TSHR (0.47) TSHRMEN1KMT2ASIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1214022-C Vitamin D analogues GALDERMA RES & DEV (FR) 2005-08-10 CN disclosed
EP-1235824-B1 VITAMIN D ANALOGUES GALDERMA RES & DEV (FR) 2004-05-19 EP disclosed
US-6706725-B1 BIAROMATIC COMPOUNDS WHICH ARE VITAMIN D ANALOGUES GALDERMA RESEARCH & DEVELOPMENT, S.N.C. (FR) 2004-03-16 US disclosed
CN-1423645-A Vitamin D analogues GALDERMA RES & DEV (FR) 2003-06-11 CN disclosed
EP-1235824-A1 VITAMIN D ANALOGUES Galderma Research & Development, S.N.C. (FR) 2002-09-04 EP disclosed
WO-2001038320-A1 VITAMIN D ANALOGUES GALDERMA RESEARCH & DEVELOPMENT, S.N.C. (FR) 2001-05-31 WO disclosed