SCHEMBL8623560

SCHEMBL8623560

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

nearest known ligand 0.69

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TRPM8 Q7Z2W7 1/20 0.69
ALDH1A1 P00352 2/20 0.58
ALOX15 P16050 1/20 0.58
CTRB1 P17538 2/20 0.57
CTSB P07858 2/20 0.53
CTSL P07711 1/20 0.53
CTSS P25774 1/20 0.53
CTSK P43235 1/20 0.53
LTA4H P09960 1/20 0.53
TACR1 P25103 2/20 0.51
KYNU Q16719 1/20 0.51
PYGL P06737 1/20 0.51
ATM Q13315 1/20 0.50
CTSD P07339 1/20 0.49
CYP3A4 P08684 1/20 0.49
TSHR P16473 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
SCHEMBL7418811 1.00 TRPM8 (0.69) TRPM8ALDH1A1ALOX15CTRB1CTSB
SCHEMBL7415444 1.00 TRPM8 (0.69) TRPM8ALDH1A1ALOX15CTRB1CTSB
SCHEMBL8163494 1.00 TRPM8 (0.69) TRPM8ALDH1A1ALOX15CTRB1CTSB
SCHEMBL9634168 0.91 TRPM8 (0.58) TRPM8ALDH1A1ALOX15CTRB1CTSB
SCHEMBL5652568 0.89 TRPM8 (0.55) TRPM8ALDH1A1ALOX15CTRB1CTSL
SCHEMBL6075360 0.89 TRPM8 (0.55) TRPM8ALDH1A1ALOX15CTRB1CTSL
SCHEMBL5653520 0.89 TRPM8 (0.55) TRPM8ALDH1A1ALOX15CTRB1CTSL
SCHEMBL7414480 0.89 TRPM8 (0.61) TRPM8ALDH1A1ALOX15CTRB1CTSB
SCHEMBL7245549 0.89 TRPM8 (0.61) TRPM8ALDH1A1ALOX15CTRB1CTSB
SCHEMBL7418088 0.89 TRPM8 (0.61) TRPM8ALDH1A1ALOX15CTRB1CTSB

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
EP-0657446-B1 Process for producing optically active erythro-3-amino-1,2-epoxy compound NIPPON KAYAKU KK (JP) 1998-05-13 EP disclosed
US-5488118-A Process for producing optically active erythro-3-amino-1,2-epoxy compound NIPPON KAYAKU KABUSHIKI KAISHA (JP) 1996-01-30 US disclosed
EP-0657446-A1 Process for producing optically active erythro-3-amino-1,2-epoxy compound NIPPON KAYAKU KABUSHIKI KAISHA (JP) 1995-06-14 EP disclosed