SCHEMBL2736202

SCHEMBL2736202

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

nearest known ligand 0.64

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TRPM8 Q7Z2W7 1/20 0.64
CTRB1 P17538 2/20 0.62
TACR1 P25103 3/20 0.59
CTSD P07339 1/20 0.56
CTSB P07858 3/20 0.55
CTSK P43235 4/20 0.54
CTSL P07711 3/20 0.54
CTSS P25774 3/20 0.54
ALDH1A1 P00352 1/20 0.53
ALOX15 P16050 1/20 0.53
ATM Q13315 1/20 0.51

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
SCHEMBL2736218 1.00 TRPM8 (0.64) TRPM8CTRB1TACR1CTSDCTSB
SCHEMBL7337287 1.00 TRPM8 (0.64) TRPM8CTRB1TACR1CTSDCTSB
SCHEMBL5916913 1.00 TRPM8 (0.64) TRPM8CTRB1TACR1CTSDCTSB
SCHEMBL4949767 1.00 TRPM8 (0.64) TRPM8CTRB1TACR1CTSDCTSB
SCHEMBL9421829 1.00 TRPM8 (0.64) TRPM8CTRB1TACR1CTSDCTSB
SCHEMBL15241328 0.92 TRPM8 (0.56) TRPM8CTRB1TACR1CTSDCTSB
SCHEMBL12249402 0.92 TRPM8 (0.59) TRPM8CTRB1TACR1CTSDCTSB
SCHEMBL7221074 0.92 TRPM8 (0.56) TRPM8CTRB1TACR1CTSDCTSB
SCHEMBL12249357 0.92 TRPM8 (0.59) TRPM8CTRB1TACR1CTSDCTSB
SCHEMBL6925966 0.92 TRPM8 (0.56) TRPM8CTRB1TACR1CTSDCTSB

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 94 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9891239-B2 Modulators of pharmacokinetic properties of therapeutics GILEAD SCIENCES, INC. (US) 2018-02-13 US disclosed
EP-3150586-A1 MODULATORS OF PHARMACOKINETIC PROPERTIES OF THERAPEUTICS Gilead Sciences, Inc. (US) 2017-04-05 EP disclosed
US-9575080-B2 2017-02-21 US disclosed
EP-3112355-A1 MODULATORS OF PHARMACOKINETIC PROPERTIES OF THERAPEUTICS GILEAD SCIENCES, INC. (US) 2017-01-04 EP disclosed
EP-2487165-B1 Modulators of pharmacokinetic properties of therapeutics GILEAD SCIENCES INC (US) 2016-09-14 EP disclosed
EP-2487162-B1 Modulators of pharmacokinetic properties of therapeutics GILEAD SCIENCES INC (US) 2016-08-17 EP disclosed
EP-2487163-B1 Modulators of pharmacokinetic properties of therapeutics GILEAD SCIENCES INC (US) 2016-08-17 EP disclosed
EP-2487161-B1 Modulators of pharmacokinetic properties of therapeutics GILEAD SCIENCES INC (US) 2016-08-10 EP disclosed
EP-2487166-B1 Modulators of pharmacokinetic properties of therapeutics GILEAD SCIENCES INC (US) 2016-07-27 EP disclosed
EP-2049506-B9 MODULATORS OF PHARMACOKINETIC PROPERTIES OF THERAPEUTICS GILEAD SCIENCES INC (US) 2016-01-13 EP disclosed
WO-1995020384-A1 PHARMACEUTICAL COMPOSITIONS CONTAINING HIV PROTEASE INHIBITORS ABBOTT LABORATORIES (US) 1995-08-03 WO disclosed
US-5430155-A Viricides, treatment of AIDS THE DU PONT MERCK PHARMACEUTICAL COMPANY (US) 1995-07-04 US disclosed
WO-1995009614-A1 PHARMACEUTICAL COMPOSITION ABBOTT LABORATORIES (US) 1995-04-13 WO disclosed
WO-1995007696-A1 PHARMACEUTICAL COMPOSITION OF HIV-PROTEASE INHIBITORS ABBOTT LABORATORIES (US) 1995-03-23 WO disclosed
US-5362912-A Process for the preparation of a substituted diaminodiol ABBOTT LABORATORIES (US) 1994-11-08 US disclosed
US-5354866-A Treating HIV infections ABBOTT LABORATORIES (US) 1994-10-11 US disclosed
WO-1994014436-A1 RETROVIRAL PROTEASE INHIBITING COMPOUNDS ABBOTT LABORATORIES (US) 1994-07-07 WO disclosed
WO-1993023361-A1 PROCESS FOR THE PREPARATION OF A SUBSTITUTED DIAMINODIOL ABBOTT LABORATORIES (US) 1993-11-25 WO disclosed
EP-0503561-A2 Method for the diastereoselective reductive pinacol coupling of homochiral alpha aminoaldehydes HOECHST AKTIENGESELLSCHAFT (DE) 1992-09-16 EP disclosed
EP-0486948-A2 Retroviral protease inhibiting compounds ABBOTT LABORATORIES (US) 1992-05-27 EP disclosed