SCHEMBL7807979

SCHEMBL7807979

O=C(NC(Cc1ccccc1)C(O)C(F)(F)C(=O)NCc1ccccc1)OCc1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TRPM8 Q7Z2W7 1/20 0.56
CTSD P07339 3/20 0.50
CTRB1 P17538 2/20 0.48
CTSB P07858 2/20 0.47
CTSL P07711 3/20 0.46
CTSS P25774 3/20 0.46
CTSK P43235 1/20 0.46
ALDH1A1 P00352 1/20 0.44
CYP1A2 P05177 1/20 0.44
CYP3A4 P08684 1/20 0.44
CYP2C9 P11712 1/20 0.44
TSHR P16473 1/20 0.44
CYP2C19 P33261 1/20 0.44
TACR1 P25103 2/20 0.44
PSMB1 P20618 1/20 0.44
REN P00797 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
SCHEMBL7809177 0.87 TRPM8 (0.49) TRPM8CTSDCTRB1CTSBCTSL
SCHEMBL7428630 0.87 TRPM8 (0.55) TRPM8CTRB1CTSBCTSLCTSS
SCHEMBL7321385 0.87 TRPM8 (0.55) TRPM8CTRB1CTSBCTSLCTSS
SCHEMBL6556306 0.85 ATM (0.54) CTSBCTSLCTSSCTSKREN
SCHEMBL6556305 0.85 ATM (0.54) CTSBCTSLCTSSCTSKREN
SCHEMBL9724730 0.85 TRPM8 (0.53) TRPM8CTRB1CTSBCTSLCTSS
SCHEMBL5704587 0.84 TRPM8 (0.57) TRPM8CTSDCTRB1CTSBCTSL
SCHEMBL8736745 0.84 CTSD (0.61) TRPM8CTSDCTSSCTSKPSMB1
SCHEMBL9081107 0.83 REN (0.49) CTSBCTSLCTSSCTSKREN
SCHEMBL7320400 0.83 TRPM8 (0.54) TRPM8CTRB1CTSBCTSLCTSS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0721449-B1 INHIBITORS OF BETA-AMYLOID PROTEIN PRODUCTION MERRELL PHARMA INC (US) 2001-12-19 EP disclosed
US-5977074-A THERAPY FOR ALZHEIMER'S DISEASE MERRELL PHARMACEUTICALS, INC. (US) 1999-11-02 US disclosed
EP-0721449-A1 INHIBITORS OF $g(b)-AMYLOID PROTEIN PRODUCTION MERRELL PHARMACEUTICALS INC. (US) 1996-07-17 EP disclosed
WO-1995009838-A1 INHIBITORS OF β-AMYLOID PROTEIN PRODUCTION MERRELL PHARMACEUTICALS INC. (US) 1995-04-13 WO disclosed