SCHEMBL3927422

SCHEMBL3927422

CCOC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)Cc1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MDM4 O15151 1/20 0.57
MDM2 Q00987 1/20 0.57
CHRNA1 P02708 3/20 0.56
CHRNG P07510 3/20 0.56
CHRNB1 P11230 3/20 0.56
CHRND Q07001 3/20 0.56
TP53 P04637 1/20 0.55
TACR1 P25103 1/20 0.54
TSHR P16473 1/20 0.54
BACE1 P56817 1/20 0.54
CTSL P07711 1/20 0.53
CTSB P07858 1/20 0.53
CTSS P25774 1/20 0.53
GRIA1 P42261 1/20 0.53
POLB P06746 1/20 0.52
EGFR P00533 1/20 0.50
PSMB8 P28062 1/20 0.50
PSMB5 P28074 1/20 0.50
ITGB3 P05106 1/20 0.49
ITGA2B P08514 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
SCHEMBL3927427 1.00 MDM4 (0.57) MDM4MDM2CHRNA1CHRNGCHRNB1
SCHEMBL11559927 0.93 TP53 (0.60) TP53TACR1CTSLCTSBCTSS
SCHEMBL13819239 0.90 ACE (0.58) MDM4MDM2CHRNA1CHRNGCHRNB1
SCHEMBL13819238 0.90 ACE (0.58) MDM4MDM2CHRNA1CHRNGCHRNB1
SCHEMBL4144661 0.90 MDM4 (0.70) MDM4MDM2CHRNA1CHRNGCHRNB1
SCHEMBL4147386 0.90 ACE (0.58) MDM4MDM2CHRNA1CHRNGCHRNB1
SCHEMBL13819237 0.90 MDM4 (0.70) MDM4MDM2CHRNA1CHRNGCHRNB1
SCHEMBL4161444 0.90 ACE (0.58) MDM4MDM2CHRNA1CHRNGCHRNB1
SCHEMBL4144658 0.90 MDM4 (0.70) MDM4MDM2CHRNA1CHRNGCHRNB1
SCHEMBL4147379 0.90 ACE (0.58) MDM4MDM2CHRNA1CHRNGCHRNB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6420424-B1 ADMINISTERING PHENYLALANINE AMIDE DERIVATIVES (SUCH AS S-ETHYL-2-AMINO-3-(4-CHLOROPHENYL)PROPIONATE HYDROCHLORIDE) TO TREAT ALLERGIC DISORDERS, INCLUDING ASTHMA, RHINITIS, DERMATITUS, AND PRURITIS SMITHKLINE BEECHAM CORPORATION 2002-07-16 US claimed
JP-2002512960-A 2002-05-08 JP claimed
EP-1073434-A1 CCR-3 RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 2001-02-07 EP claimed
WO-1999055330-A1 CCR-3 RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 1999-11-04 WO claimed
EP-1691199-B1 METHOD OF PREDICTING SPOT FORMATION ON THE SKIN WITH THE USE OF SPOT SITE-ACCELERATING GENES AS INDICATION AND METHOD OF SCREENING INHIBITOR FOR SPOT FORMATION ON THE SKIN SHISEIDO CO LTD (JP) 2009-04-01 EP disclosed
US-20070249915-A1 Inhibitors SHISEIDO COMPANY, LTD. (JP) 2007-10-25 US disclosed
EP-1691199-A1 METHOD OF PREDICTING SPOT FORMATION ON THE SKIN WITH THE USE OF SPOT SITE-ACCELERATING GENES AS INDICATION AND METHOD OF SCREENING INHIBITOR FOR SPOT FORMATION ON THE SKIN SHISEIDO COMPANY LIMITED (JP) 2006-08-16 EP disclosed
US-6420424-B1 ADMINISTERING PHENYLALANINE AMIDE DERIVATIVES (SUCH AS S-ETHYL-2-AMINO-3-(4-CHLOROPHENYL)PROPIONATE HYDROCHLORIDE) TO TREAT ALLERGIC DISORDERS, INCLUDING ASTHMA, RHINITIS, DERMATITUS, AND PRURITIS SMITHKLINE BEECHAM CORPORATION 2002-07-16 US disclosed
EP-1073434-A1 CCR-3 RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 2001-02-07 EP disclosed
WO-1999055330-A1 CCR-3 RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 1999-11-04 WO disclosed