SCHEMBL11078232

SCHEMBL11078232

CCC(C(=O)O)C1Cc2ccc(Cl)cc2C1=O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 4/20 0.38
PPARA Q07869 4/20 0.38
HTR2A P28223 3/20 0.36
HTR2C P28335 3/20 0.36
HTR2B P41595 2/20 0.36
SLC1A3 P43003 1/20 0.36
SLC1A2 P43004 1/20 0.36
SLC1A1 P43005 1/20 0.36
NOTUM Q6P988 1/20 0.36
HTR1A P08908 1/20 0.36
DRD2 P14416 1/20 0.36
DRD4 P21917 1/20 0.36
HTR7 P34969 1/20 0.36
DRD3 P35462 1/20 0.36
METAP1 P53582 1/20 0.36
HHAT Q5VTY9 1/20 0.36
SDCBP O00560 1/20 0.34
SDC2 P34741 1/20 0.34
MDM2 Q00987 1/20 0.34
XIAP P98170 1/20 0.34

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
SCHEMBL11083423 0.90 MDM2 (0.39) PPARGPPARAHTR2AHTR2CHTR2B
SCHEMBL11078543 0.85 ACHE (0.50) PPARGPPARAHTR2AHTR2CHTR2B
SCHEMBL1641257 0.84 EDNRB (0.37) HTR2AHTR2CHTR2BSLC1A3SLC1A2
SCHEMBL11084848 0.84 ACHE (0.51) PPARGPPARASLC1A3SLC1A2SLC1A1
SCHEMBL11077273 0.82 HTR2A (0.39) HTR2AHTR2CHTR2BSLC1A3SLC1A2
SCHEMBL11083966 0.80 METAP1 (0.45) PPARAHTR2AHTR2CHTR2BSLC1A3
SCHEMBL15617646 0.77 HTR2A (0.41) HTR2AHTR2CHTR2BNOTUMHTR1A
SCHEMBL11085584 0.74 EDNRB (0.35) HTR2AHTR2CHTR2BSLC1A3SLC1A2
SCHEMBL11088030 0.74 ACHE (0.49) SLC1A3SLC1A2SLC1A1DRD3MDM2
SCHEMBL11080573 0.74 AADAT (0.35) PPARGPPARANOTUMHTR1ADRD2

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-4443626-A ANTIINFLAMMATORY, ANTIALLERGENS, ANALGESICS, ANTICOAGULANTS, ANTIPRETICS, OR ANTICHOLESTEROL AGENTS HISAMITSU PHARMACEUTICAL CO., INC. (JP) 1984-04-17 US claimed
US-4443626-A ANTIINFLAMMATORY, ANTIALLERGENS, ANALGESICS, ANTICOAGULANTS, ANTIPRETICS, OR ANTICHOLESTEROL AGENTS HISAMITSU PHARMACEUTICAL CO., INC. (JP) 1984-04-17 US disclosed