SCHEMBL10985678

SCHEMBL10985678

Clc1ccc(NNBr)cc1Cl

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.52
GAA P10253 2/20 0.52
GLA P06280 1/20 0.52
EPHX1 P07099 2/20 0.48
EPHX2 P34913 2/20 0.48
CA2 P00918 1/20 0.44
CA4 P22748 1/20 0.44
CA5A P35218 1/20 0.44
CA9 Q16790 1/20 0.44
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
NPC1 O15118 3/20 0.42
RAB9A P51151 2/20 0.42
IDO1 P14902 1/20 0.42
KDM4E B2RXH2 1/20 0.42
PKM P14618 1/20 0.42
RAPGEF4 Q8WZA2 1/20 0.42
LMNA P02545 1/20 0.42
ADORA3 P0DMS8 1/20 0.42
CHRM1 P11229 1/20 0.42

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
SCHEMBL10994330 0.80 MAPT (0.40) MAPTGAAGLAMEN1KMT2A
SCHEMBL10255934 0.78 MAPT (0.53) MAPTGAAGLAEPHX1EPHX2
SCHEMBL27714137 0.74 ALDH1A1 (0.55) MAPTGAAGLAEPHX1EPHX2
SCHEMBL12614443 0.74 RAPGEF4 (0.59) MAPTGAAGLAEPHX1EPHX2
SCHEMBL11611979 0.72 EPHX1 (0.54) MAPTGAAGLAEPHX1EPHX2
SCHEMBL15058272 0.72 PTGS2 (0.45) MAPTGAACA2MEN1KMT2A
SCHEMBL23044005 0.71 SLC2A1 (0.53) MAPTGAAGLAEPHX1EPHX2
SCHEMBL14511215 0.71 MAPT (0.47) MAPTGAAGLAEPHX1EPHX2
Hydrochloric Acid SCHEMBL4585173 0.70 PTGS2 (0.43) MAPTGAACA2MEN1KMT2A
SCHEMBL11052606 0.70 EPHX1 (0.58) MAPTGAAGLAEPHX1EPHX2

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-0034945-B1 N-PHENYLPYRAZOLE DERIVATIVES MAY & BAKER LIMITED (GB) 1985-08-07 EP disclosed
US-4496390-A WEED-CONTRTOLLING HERBICIDES MAY & BAKER LIMITED (GB) 1985-01-29 US disclosed
EP-0034945-A2 N-phenylpyrazole derivatives MAY & BAKER LIMITED (GB) 1981-09-02 EP disclosed