SCHEMBL28760134

SCHEMBL28760134

Cc1ccccc1C(C)N1CC(=O)NC1=O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.48
TRPC5 Q9UL62 1/20 0.46
MAPT P10636 2/20 0.40
CRBN Q96SW2 2/20 0.40
DDB1 Q16531 1/20 0.40
ALDH1A1 P00352 2/20 0.38
LMNA P02545 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
OPRM1 P35372 3/20 0.35
OPRD1 P41143 3/20 0.35
OPRK1 P41145 3/20 0.35
OPRL1 P41146 3/20 0.35
TOP2A P11388 1/20 0.35
TOP2B Q02880 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
ESR1 P03372 1/20 0.35
USP2 O75604 1/20 0.35
P2RX7 Q99572 1/20 0.34
ALOX5 P09917 1/20 0.34
HRH2 P25021 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
SCHEMBL9435770 0.78 MAPK1 (0.50) HSD11B1MAPK1
SCHEMBL11655966 0.75 MAPT (0.51) HSD11B1TRPC5MAPTCRBNDDB1
SCHEMBL3974078 0.71 HSD11B1 (0.51) HSD11B1TRPC5LMNAESR1P2RX7
SCHEMBL378251 0.68 TOP2A (0.50) MAPTCRBNALDH1A1LMNATOP2A
SCHEMBL16597500 0.68 TOP2A (0.50) MAPTCRBNALDH1A1LMNATOP2A
SCHEMBL2536247 0.67 DDB1 (0.72) MAPTCRBNDDB1ALDH1A1SMN1; SMN2
SCHEMBL5597469 0.67 RAB9A (0.43) MAPTCRBNDDB1ALDH1A1LMNA
SCHEMBL10765254 0.65 TOP2A (0.46) MAPTCRBNALDH1A1LMNATOP2A
SCHEMBL11086765 0.65 TOP2A (0.46) MAPTCRBNALDH1A1LMNATOP2A
SCHEMBL27618934 0.65 TOP2A (0.46) MAPTCRBNALDH1A1LMNATOP2A

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
CN-101863877-A Be used for the treatment of the treatment of pain agent EURO CELTIQUE SA 2010-10-20 CN disclosed
CN-1835751-B Therapeutic agent for treating pain EURO CELTIQUE SA 2010-06-23 CN disclosed
CN-1835751-A therapeutic agent for treating pain EURO CELTIQUE SA (LU) 2006-09-20 CN disclosed