SCHEMBL7424210

SCHEMBL7424210

COC(=O)[C@@H](NCc1ccccc1)C(C)O

nearest known ligand 0.63

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TRPM8 Q7Z2W7 1/20 0.58
MAPT P10636 2/20 0.54
L3MBTL1 Q9Y468 1/20 0.54
KMT2A Q03164 4/20 0.52
MEN1 O00255 2/20 0.52
ATM Q13315 1/20 0.48
SIGMAR1 Q99720 1/20 0.46
CTSL P07711 1/20 0.45
CTSS P25774 1/20 0.45
ANPEP P15144 1/20 0.44
ALDH1A1 P00352 2/20 0.44
POLB P06746 1/20 0.44
HCRTR2 O43614 1/20 0.44
CYP2C19 P33261 2/20 0.43
THRB P10828 1/20 0.43
CYP2C9 P11712 1/20 0.43
HSD17B10 Q99714 1/20 0.43
CTSD P07339 1/20 0.43
CYP3A4 P08684 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
SCHEMBL19520949 1.00 TRPM8 (0.58) TRPM8MAPTL3MBTL1KMT2AMEN1
SCHEMBL7424214 1.00 TRPM8 (0.58) TRPM8MAPTL3MBTL1KMT2AMEN1
SCHEMBL30220325 1.00 TRPM8 (0.58) TRPM8MAPTL3MBTL1KMT2AMEN1
SCHEMBL19520951 1.00 TRPM8 (0.58) TRPM8MAPTL3MBTL1KMT2AMEN1
SCHEMBL16851474 1.00 TRPM8 (0.58) TRPM8MAPTL3MBTL1KMT2AMEN1
SCHEMBL1109206 0.91 ALDH1A1 (0.52) TRPM8MAPTL3MBTL1KMT2AMEN1
SCHEMBL1095999 0.91 ALDH1A1 (0.52) TRPM8MAPTL3MBTL1KMT2AMEN1
SCHEMBL24326690 0.89 TRPM8 (0.59) TRPM8MAPTL3MBTL1KMT2AMEN1
SCHEMBL1889631 0.89 TRPM8 (0.59) TRPM8MAPTL3MBTL1KMT2AMEN1
SCHEMBL1889629 0.89 TRPM8 (0.59) TRPM8MAPTL3MBTL1KMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0900211-A1 THIADIAZOLYL(THIO)UREAS USEFUL AS MATRIX METALLOPROTEASE INHIBITORS PHARMACIA & UPJOHN COMPANY (US) 1999-03-10 EP claimed
WO-1997040031-A1 THIADIAZOLYL(THIO)UREAS USEFUL AS MATRIX METALLOPROTEASE INHIBITORS PHARMACIA & UPJOHN COMPANY (US) 1997-10-30 WO claimed