SCHEMBL19417415

SCHEMBL19417415

Cc1cc2c(cc1Br)Oc1cc(Br)ccc1N2C

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ AHR P35869 6/20 0.46
▸ MEN1 O00255 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ ALOX15 P16050 1/20 0.31
▸ ALOX12 P18054 1/20 0.31
▸ HBB P68871 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ HSD17B10 Q99714 1/20 0.31
▸ MYC P01106 1/20 0.30
▸ NR4A1 P22736 1/20 0.30
▸ TSHR P16473 1/20 0.30

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
SCHEMBL19417350 0.88 AHR (0.55) AHRMEN1MAPTKMT2A
SCHEMBL31314363 0.86 AHR (0.54) AHRMEN1MAPTKMT2AMYC
SCHEMBL46737 0.83 AHR (0.52) AHRMEN1MAPTKMT2ATSHR
SCHEMBL19417312 0.78 AHR (0.55) AHRMAPTALOX15HSD17B10
SCHEMBL19417332 0.77 AHR (0.44) AHRMEN1MAPTKMT2A
SCHEMBL19417416 0.75 AHR (0.54) AHRMEN1MAPTKMT2ATSHR
SCHEMBL31314477 0.73 AHR (0.44) AHR
SCHEMBL11976516 0.72 TSHR (0.32) TSHR
SCHEMBL31314293 0.70 CYP2A6 (0.44) AHRMEN1MAPTKMT2AHSD17B10
SCHEMBL31314172 0.70 GABRP (0.42) AHRMEN1MAPTKMT2A

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
EP-3225610-A1 METHOD FOR MANUFACTURING COMPOUND Sumitomo Chemical Company, Limited (JP) 2017-10-04 — — EP disclosed
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