SCHEMBL9511283

SCHEMBL9511283

CCc1cccc(-c2cc(OC)ccc2C(=O)O)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTB4R Q15722 1/20 0.53
LTB4R2 Q9NPC1 1/20 0.53
BCL2 P10415 1/20 0.50
RAB9A P51151 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
THRA P10827 1/20 0.47
THRB P10828 1/20 0.47
PTPN11 Q06124 1/20 0.46
KMT2A Q03164 1/20 0.46
PLG P00747 1/20 0.45
PLAU P00749 1/20 0.45
POLQ O75417 1/20 0.45
FFAR1 O14842 4/20 0.45
AKR1C3 P42330 2/20 0.45
AKR1C2 P52895 2/20 0.45
KDM4E B2RXH2 1/20 0.45
POLB P06746 1/20 0.45
PPARG P37231 1/20 0.44
DHODH Q02127 1/20 0.44
PPARD Q03181 1/20 0.44

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
SCHEMBL8202718 0.86 PRKAB2 (0.55) LTB4RLTB4R2SMN1; SMN2AKR1C3AKR1C2
SCHEMBL8069413 0.85 SMN1; SMN2 (0.59) LTB4RLTB4R2RAB9ASMN1; SMN2KMT2A
SCHEMBL6701301 0.82 SMN1; SMN2 (0.63) LTB4RLTB4R2SMN1; SMN2AKR1C3AKR1C2
SCHEMBL31619636 0.82 SMN1; SMN2 (0.51) LTB4RLTB4R2RAB9ASMN1; SMN2AKR1C3
SCHEMBL18414391 0.80 BCL2 (0.58) LTB4RLTB4R2BCL2RAB9ASMN1; SMN2
SCHEMBL9288089 0.79 CYP1A1 (0.50) BCL2RAB9ASMN1; SMN2THRATHRB
SCHEMBL7591657 0.78 SMN1; SMN2 (0.75) SMN1; SMN2AKR1C3AKR1C2KDM4EPOLB
SCHEMBL4601656 0.77 PLA2G2A (0.64) RAB9ASMN1; SMN2KMT2AKDM4EPOLB
SCHEMBL10909137 0.76 PTPN1 (0.53) LTB4R2BCL2RAB9ASMN1; SMN2
SCHEMBL20208770 0.76 KDM4E (0.56) SMN1; SMN2AKR1C3AKR1C2KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0379290-B1 Flux composition COOKSON GROUP PLC (GB) 1993-10-27 EP claimed