SCHEMBL9623640

SCHEMBL9623640

O=C(CF)Nc1ccc(S(=O)(=O)Cl)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRMT1 Q99873 2/20 0.54
ATM Q13315 1/20 0.50
ALB P02768 1/20 0.49
MMP1 P03956 1/20 0.49
MMP2 P08253 1/20 0.49
MMP3 P08254 1/20 0.49
MMP9 P14780 1/20 0.49
MMP12 P39900 1/20 0.49
MMP13 P45452 1/20 0.49
MMP14 P50281 1/20 0.49
CA1 P00915 12/20 0.49
CA2 P00918 12/20 0.49
CA9 Q16790 8/20 0.47
CA12 O43570 6/20 0.47
KMT2A Q03164 2/20 0.47
MEN1 O00255 1/20 0.47
CA4 P22748 2/20 0.46
CA7 P43166 2/20 0.46
CA14 Q9ULX7 1/20 0.45
CA5A P35218 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
SCHEMBL8047403 0.84 PRMT1 (0.77) PRMT1ATMCA1CA2CA9
SCHEMBL28121835 0.82 CA1 (0.72) CA1CA2CA9CA12KMT2A
SCHEMBL1102000 0.82 ATM (0.74) PRMT1ATMCA1CA2CA9
SCHEMBL30699954 0.82 PRMT1 (0.54) PRMT1ATMCA1CA2CA9
SCHEMBL12113370 0.81 KMT2A (0.54) PRMT1ATMMMP2MMP14CA1
SCHEMBL10946868 0.79 CA1 (0.71) PRMT1ATMCA1CA2CA9
SCHEMBL8876305 0.77 ALDH1A1 (0.58) KMT2AMEN1
SCHEMBL8247039 0.77 ALDH1A1 (0.48) PRMT1ATMMMP1MMP2MMP9
SCHEMBL9391202 0.76 GSTO1 (0.55) KMT2AMEN1
SCHEMBL1034515 0.76 NPC1 (0.59) PRMT1CA1CA2CA9CA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0178581-B1 Use of 2-[(2-bromo-6-fluorophenyl)imino]imidazolidine as a sedative BOEHRINGER INGELHEIM VETMEDICA GMBH (DE) 1992-01-22 EP disclosed
US-4624960-A 2-112-BROMO-6-FLUOROPHENYLIMINOIMIDAZOLIDINE BOEHRINGER INGELHEIM VETMEDICA GMBH (DE) 1986-11-25 US disclosed
EP-0178581-A2 Use of 2-[(2-bromo-6-fluorophenyl)imino]imidazolidine as a sedative BOEHRINGER INGELHEIM VETMEDICA GMBH (DE) 1986-04-23 EP disclosed