SCHEMBL8749392

SCHEMBL8749392

Cc1cc(O)cc(Oc2ccc(C(F)(F)F)cc2Cl)c1

nearest known ligand 0.68

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 6/20 0.49
FFAR1 O14842 5/20 0.49
MEN1 O00255 1/20 0.46
TTR P02766 1/20 0.46
PPOX P50336 1/20 0.46
KMT2A Q03164 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
HTR2A P28223 3/20 0.41
SLC6A4 P31645 3/20 0.41
KCNH2 Q12809 3/20 0.41
EPAS1 Q99814 1/20 0.41
RAB9A P51151 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
SCHEMBL8748952 0.86 FFAR1 (0.49) MRGPRX4FFAR1MEN1TTRPPOX
SCHEMBL4515853 0.81 HTR2A (0.42) MRGPRX4HTR2ASLC6A4KCNH2RAB9A
SCHEMBL8684467 0.81 FFAR1 (0.61) MRGPRX4FFAR1MEN1TTRPPOX
SCHEMBL15384989 0.81 HTR2A (0.59) FFAR1MEN1TTRPPOXKMT2A
SCHEMBL7597428 0.80 L3MBTL1 (0.51) MRGPRX4FFAR1MEN1TTRPPOX
SCHEMBL8749364 0.80 RAB9A (0.61) MRGPRX4FFAR1MEN1TTRPPOX
SCHEMBL11345830 0.79 ALDH1A1 (0.46) HTR2ASLC6A4KCNH2RAB9A
SCHEMBL11095176 0.78 FFAR1 (0.65) MRGPRX4FFAR1MEN1TTRPPOX
SCHEMBL10615136 0.78 FFAR1 (0.55) MRGPRX4FFAR1MEN1TTRPPOX
SCHEMBL32669004 0.78 FFAR1 (0.55) MRGPRX4FFAR1MEN1TTRPPOX

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0768085-A1 ANTIBACTERIAL AGENT DAIICHI PHARMACEUTICAL CO., LTD. (JP) 1997-04-16 EP disclosed
EP-0761215-A1 ANTIBACTERIAL AGENT DAIICHI PHARMACEUTICAL CO., LTD. (JP) 1997-03-12 EP disclosed