SCHEMBL9327414

SCHEMBL9327414

CCCC(Oc1ccc(C(=O)O)cc1)C(=O)OC

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.51
PPARG P37231 2/20 0.48
PPARA Q07869 2/20 0.48
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
TAS1R3 Q7RTX0 2/20 0.46
TAS1R1 Q7RTX1 2/20 0.46
MAPK1 P28482 1/20 0.45
TP53 P04637 1/20 0.45
TSHR P16473 1/20 0.45
PLA2G4B P0C869 4/20 0.44
RARB P10826 3/20 0.42
HTT P42858 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
SCHEMBL9327394 0.89 KMT2A (0.53) KMT2APPARGPPARACA1CA2
SCHEMBL9329257 0.89 TP53 (0.55) KMT2ATP53TSHRPLA2G4BRARB
SCHEMBL7999041 0.88 PPARG (0.50) KMT2APPARGPPARATAS1R3TAS1R1
SCHEMBL2230124 0.86 PPARG (0.63) KMT2APPARGPPARACA1CA2
SCHEMBL7335069 0.86 PPARG (0.55) KMT2APPARGPPARATSHR
SCHEMBL28686243 0.81 KMT2A (0.47) KMT2APPARGPPARACA1CA2
SCHEMBL9327404 0.81 HTT (0.46) KMT2APPARGPPARATP53TSHR
SCHEMBL5162436 0.79 RAB9A (0.51) KMT2ACA1CA2MAPK1TSHR
SCHEMBL13572608 0.79 ELANE (0.47) PPARGPPARAHTT
SCHEMBL1952125 0.79 KMT2A (0.59) KMT2ACA1CA2MAPK1TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0368912-B1 POLYANHYDRIDES WITH IMPROVED HYDROLYTIC DEGRADATION PROPERTIES MASSACHUSETTS INST TECHNOLOGY (US) 1994-03-16 EP disclosed
EP-0368912-A4 POLYANHYDRIDES WITH IMPROVED HYDROLYTIC DEGRADATION PROPERTIES 1990-12-19 EP disclosed
EP-0368912-A1 POLYANHYDRIDES WITH IMPROVED HYDROLYTIC DEGRADATION PROPERTIES. MASSACHUSETTS INST TECHNOLOGY (US) 1990-05-23 EP disclosed
US-4857311-A FROM P-CARBOXYPHEN(-OXY OR -YL)ALKANOIC ACID; BIODEGRADABLE MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 1989-08-15 US disclosed
WO-1989000855-A1 POLYANHYDRIDES WITH IMPROVED HYDROLYTIC DEGRADATION PROPERTIES MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 1989-02-09 WO disclosed