SCHEMBL8482123

SCHEMBL8482123

NC(=O)OC(Cc1ccc2ccccc2c1)C(=O)NCc1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
FCER2 P06734 2/20 0.51
NLN Q9BYT8 1/20 0.48
MMP2 P08253 1/20 0.48
MMP9 P14780 1/20 0.48
MMP8 P22894 1/20 0.48
PPARG P37231 1/20 0.47
PPARA Q07869 1/20 0.47
NR1H4 Q96RI1 1/20 0.45
MC5R P33032 2/20 0.45
MC1R Q01726 2/20 0.45
CTSL P07711 1/20 0.44
CTSB P07858 1/20 0.44
CTSS P25774 1/20 0.44
FAAH O00519 1/20 0.44
METAP2 P50579 1/20 0.43
METAP1 P53582 1/20 0.43
MMP1 P03956 1/20 0.43
TPSAB1 Q15661 1/20 0.42

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
SCHEMBL28535787 0.86 MMP1 (0.44) FCER2NLNMMP9PPARGPPARA
SCHEMBL5556817 0.81 NLN (0.62) FCER2NLNMMP2MMP9MMP8
SCHEMBL28431707 0.80 MMP8 (0.44) MMP8PPARGPPARA
SCHEMBL12505311 0.79 CYP2D6 (0.49) MMP8
SCHEMBL28571404 0.78 MEN1 (0.49) CTSLCTSBCTSS
SCHEMBL7276245 0.77 PPARG (0.45) FCER2PPARGPPARAMC5RMC1R
SCHEMBL7276239 0.77 PPARG (0.45) FCER2PPARGPPARAMC5RMC1R
SCHEMBL8201136 0.76 FCER2 (0.69) FCER2MMP2MMP9MMP8CTSL
SCHEMBL8201134 0.76 FCER2 (0.69) FCER2MMP2MMP9MMP8CTSL
SCHEMBL14696850 0.76 CA12 (0.59) MMP8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5856354-A RESPIRATORY SYSTEM DISORDERS, ANTIINFLAMMATORY AGENTS, GASTROINTESTINAL DISORDERS, VISION DEFECTS, ANTIALLERGENS,PAIN, NERVOUS SYSTEM DISORDERS, HEADACHES WARNER-LAMBERT COMPANY (US) 1999-01-05 US disclosed
US-5716979-A NONPEPTIDES, UNIQUE IN ALKYLATION/SUBSTITUTION PATTERN ALONG THEIR BACKBONE, USEFUL FOR TREATING DISORDERS SUCH AS RESPIRATORY, INFLAMMATORY, GASTROINTESTINAL, OPHTHALMIC, ALLERGIES, PAIN, VASCULAR, MIGRANE, ARTHRITIS AND BRAIN WARNER-LAMBERT COMPANY (US) 1998-02-10 US disclosed