SCHEMBL19257563

SCHEMBL19257563

CCc1cccc(-c2ccc(-c3ccc(OC(F)(F)F)cc3C(=O)O)cc2C)c1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PTPN11 Q06124 2/20 0.49
IGF2BP2 Q9Y6M1 1/20 0.45
BCL2 P10415 1/20 0.44
MMP2 P08253 2/20 0.44
MMP3 P08254 2/20 0.44
FFAR1 O14842 4/20 0.43
FFAR4 Q5NUL3 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.42
DHODH Q02127 2/20 0.42
MRGPRX4 Q96LA9 1/20 0.41
PPARG P37231 2/20 0.41
XDH P47989 1/20 0.41
PPARA Q07869 1/20 0.41

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
SCHEMBL19257271 0.88 IGF2BP2 (0.47) PTPN11IGF2BP2MMP2MMP3FFAR1
SCHEMBL20594547 0.82 IGF2BP2 (0.54) PTPN11IGF2BP2SMN1; SMN2DHODHMRGPRX4
SCHEMBL19209484 0.82 MCL1 (0.50) PTPN11IGF2BP2MMP2MMP3FFAR1
SCHEMBL27636056 0.78 IGF2BP2 (0.59) IGF2BP2FFAR1FFAR4SMN1; SMN2DHODH
SCHEMBL14126262 0.77 AKR1C3 (0.54) PTPN11IGF2BP2FFAR4MRGPRX4PPARG
SCHEMBL18414391 0.74 BCL2 (0.58) PTPN11BCL2SMN1; SMN2PPARG
SCHEMBL19257233 0.73 SMN1; SMN2 (0.63) PTPN11MMP2MMP3FFAR1SMN1; SMN2
SCHEMBL9511283 0.73 LTB4R (0.53) PTPN11BCL2FFAR1SMN1; SMN2DHODH
SCHEMBL13099463 0.73 BCL2 (0.51) BCL2MRGPRX4
SCHEMBL22109071 0.72 KDM4E (0.56) IGF2BP2DHODHMRGPRX4

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
WO-2017134146-A1 GPBP INHIBITORS AND USES AND SCALEABLE SYNTHESIS THEREOF FIBROSTATIN, S.L. (ES) 2017-08-10 WO disclosed