SCHEMBL9328682

SCHEMBL9328682

CCCCCCCC(=O)OC(=O)C(CCCCCC)Oc1ccc(C(=O)O)cc1

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.50
TSHR P16473 1/20 0.50
PLA2G4B P0C869 7/20 0.49
RARB P10826 4/20 0.47
HTT P42858 1/20 0.47
PLA2G4A P47712 1/20 0.45
CTRC Q99895 1/20 0.43
KMT2A Q03164 1/20 0.42
PTPN11 Q06124 1/20 0.40

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
SCHEMBL9328675 0.91 TP53 (0.56) TP53TSHRPLA2G4BRARBHTT
SCHEMBL9327404 0.90 HTT (0.46) TP53TSHRPLA2G4BRARBHTT
SCHEMBL11617523 0.89 CTRC (0.47) CTRCKMT2A
SCHEMBL11577658 0.89 CTRC (0.47) CTRCKMT2A
SCHEMBL9329257 0.85 TP53 (0.55) TP53TSHRPLA2G4BRARBHTT
SCHEMBL8133487 0.83 TP53 (0.59) TP53TSHRPLA2G4BRARBPLA2G4A
SCHEMBL2255421 0.83 TP53 (0.59) TP53TSHRPLA2G4BRARBPLA2G4A
SCHEMBL11589038 0.82 TP53 (0.56) TP53TSHRPLA2G4BRARBPLA2G4A
SCHEMBL10378989 0.81 TP53 (0.56) TP53TSHRPLA2G4BRARBPLA2G4A
SCHEMBL10378987 0.81 TP53 (0.56) TP53TSHRPLA2G4BRARBPLA2G4A

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