SCHEMBL9508788

SCHEMBL9508788

FCc1ccc(Oc2ccc(CF)cc2)cc1

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ST14 Q9Y5Y6 3/20 0.48
LTA4H P09960 5/20 0.46
HRH3 Q9Y5N1 1/20 0.41
TSHR P16473 2/20 0.41
ALDH1A1 P00352 1/20 0.41
CYP3A4 P08684 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
ESR1 P03372 1/20 0.41
ESR2 Q92731 1/20 0.41
FFAR1 O14842 1/20 0.39
SRD5A2 P31213 2/20 0.38
EPHX2 P34913 1/20 0.36

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
SCHEMBL4553528 0.88 ESR1 (0.64) LTA4HMEN1KMT2AESR1ESR2
SCHEMBL14781239 0.88 TEAD4 (0.52) ST14LTA4HALDH1A1TDP1MEN1
SCHEMBL1338455 0.80 HRH3 (0.35) HRH3TSHRALDH1A1CYP3A4TDP1
SCHEMBL17801433 0.78 HRH3 (0.39) ST14HRH3TSHRALDH1A1CYP3A4
SCHEMBL1895592 0.78 IDO1 (0.58) LTA4HTSHRALDH1A1CYP3A4
SCHEMBL9747888 0.77 MAOB (0.50) ALDH1A1
SCHEMBL16455357 0.77 LTA4H (0.56) ST14LTA4HTSHRALDH1A1MEN1
SCHEMBL1191309 0.76 HRH3 (0.38) HRH3
SCHEMBL15958746 0.76 NQO1 (0.70) LTA4HHRH3TSHRALDH1A1TDP1
SCHEMBL24750331 0.74 ALDH1A1 (0.56) TSHRALDH1A1CYP3A4MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0311387-B1 AROMATIC AMINE RESINS, THEIR PRODUCTION PROCESS AND THERMOSETTING RESIN COMPOSITIONS MAKING USE OF THE SAME MITSUI TOATSU CHEMICALS, Inc. (JP) 1993-08-11 EP disclosed
US-5145949-A Production process for making aromatic amine resins MITSUI TOATSU CHEMICALS, INC. (JP) 1992-09-08 US disclosed
US-5106953-A Reacting aromatic amines with bishalogenomethyl derivatives; curing agents or raw materials for polyamides MITSUI TOATSU CHEMICALS, INC. (JP) 1992-04-21 US disclosed
US-5051494-A A bismaleimide and an amino resin MITSUI TOATSU CHEMICALS, INC. (JP) 1991-09-24 US disclosed
US-4937318-A Aromatic amine resins MITSUI TOATSU CHEMICALS, INC. (JP) 1990-06-26 US disclosed
EP-0311387-A2 Aromatic amine resins, their production process and thermosetting resin compositions making use of the same MITSUI TOATSU CHEMICALS, Inc. (JP) 1989-04-12 EP disclosed