SCHEMBL7280375

SCHEMBL7280375

COC(=O)C[C@H](Cc1ccccc1)NC(=O)OCc1ccccc1

nearest known ligand 0.68

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CTRB1 P17538 2/20 0.68
TRPM8 Q7Z2W7 1/20 0.55
ALDH1A1 P00352 1/20 0.55
ALOX15 P16050 1/20 0.55
ABCB1 P08183 1/20 0.54
CTSL P07711 2/20 0.53
CTSK P43235 2/20 0.53
CTSB P07858 1/20 0.53
CTSS P25774 1/20 0.53
CYP3A4 P08684 1/20 0.52
TACR1 P25103 2/20 0.51
SYK P43405 1/20 0.51
REN P00797 1/20 0.51
ATM Q13315 1/20 0.50
ITGB3 P05106 1/20 0.49
ITGA2B P08514 1/20 0.49
CAPN1 P07384 1/20 0.49

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
SCHEMBL28184491 1.00 CTRB1 (0.68) CTRB1TRPM8ALDH1A1ALOX15ABCB1
SCHEMBL10966776 0.93 CTRB1 (0.61) CTRB1TRPM8ALDH1A1ALOX15ABCB1
SCHEMBL7682035 0.92 CTRB1 (0.72) CTRB1TRPM8ALDH1A1ALOX15CTSL
SCHEMBL7682037 0.92 CTRB1 (0.72) CTRB1TRPM8ALDH1A1ALOX15CTSL
SCHEMBL10964829 0.89 CTRB1 (0.57) CTRB1TRPM8ALDH1A1ALOX15SYK
SCHEMBL14531561 0.89 SYK (0.60) CTRB1TRPM8ALDH1A1ALOX15ABCB1
SCHEMBL555191 0.89 CTRB1 (0.57) CTRB1TRPM8ALDH1A1ALOX15ABCB1
SCHEMBL79250 0.89 CTRB1 (0.57) CTRB1TRPM8ALDH1A1ALOX15ABCB1
SCHEMBL14530318 0.89 SYK (0.60) CTRB1TRPM8ALDH1A1ALOX15ABCB1
SCHEMBL10964840 0.89 CTRB1 (0.57) CTRB1TRPM8ALDH1A1ALOX15SYK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0136883-A2 Enkephalinase inhibitors E.R. Squibb & Sons, Inc. (US) 1985-04-10 EP disclosed