SCHEMBL8957202

SCHEMBL8957202

CCCc1c(O)ccc(C(=O)NC)c1O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLK1 P53350 3/20 0.46
PRKCI P41743 1/20 0.40
NPC1 O15118 1/20 0.40
POLB P06746 1/20 0.40
RAB9A P51151 1/20 0.40
KMT2A Q03164 1/20 0.40
MCOLN3 Q8TDD5 1/20 0.40
CTDSP1 Q9GZU7 1/20 0.40
EGFR P00533 1/20 0.38
PPARG P37231 2/20 0.37
PPARD Q03181 2/20 0.37
PPARA Q07869 2/20 0.37
GAA P10253 1/20 0.37
MCL1 Q07820 1/20 0.36
GRM2 Q14416 1/20 0.36
LMNA P02545 1/20 0.36
CYP1A2 P05177 1/20 0.36
MAPT P10636 1/20 0.36
CYP2C9 P11712 1/20 0.36
NFKB1 P19838 1/20 0.36

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
SCHEMBL480388 0.82 CYP1A2 (0.50) PRKCIKMT2APPARGPPARDPPARA
SCHEMBL30736074 0.82 CYP1A2 (0.50) PRKCIKMT2APPARGPPARDPPARA
SCHEMBL10726758 0.82 SELL (0.53) PRKCIPPARGPPARDPPARAMCL1
SCHEMBL7041532 0.81 CA12 (0.46) PRKCIKMT2AEGFRPPARGPPARD
SCHEMBL4017548 0.81 HSP90AB1 (0.49) PRKCIPOLBKMT2APPARGPPARD
SCHEMBL8957148 0.81 PRKCI (0.41) PRKCIPPARGPPARDPPARAMCL1
SCHEMBL7044950 0.79 HPGD (0.49) PRKCIKMT2ALMNAMAPT
SCHEMBL9821864 0.79 PRKCI (0.44) PRKCIPPARGPPARAGAAMCL1
SCHEMBL2862125 0.79 MAPT (0.49) KMT2AGAAMCL1LMNACYP1A2
SCHEMBL7041417 0.78 CYP1A2 (0.47) PRKCIPPARGPPARDPPARAMCL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5532383-A Leukotriene B4 antagonists G. D. SEARLE & CO. (US) 1996-07-02 US disclosed
EP-0593478-B1 LEUKOTRIENE B 4 ANTAGONISTS SEARLE & CO (US) 1995-12-06 EP disclosed
US-5439937-A Leukotriene B4 antagonists G. D. SEARLE & CO. (US) 1995-08-08 US disclosed
US-5310951-A Benzopyran-2-propanoic acid derivatives; antiinflammatory agents G.D. SEARLE & CO. (US) 1994-05-10 US disclosed
EP-0593478-A1 LEUKOTRIENE B 4? ANTAGONISTS. SEARLE & CO (US) 1994-04-27 EP disclosed
US-5124350-A Antiinflammatory agent G. D. SEARLE & CO. (US) 1992-06-23 US disclosed
WO-1992000011-A2 LEUKOTRIENE B4 ANTAGONISTS G.D. SEARLE & CO. (US) 1992-01-09 WO disclosed