SCHEMBL10694857

SCHEMBL10694857

O=[N+]([O-])c1cc(Br)ccc1N=Cc1ccccc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 8/20 0.44
▸ KMT2A Q03164 8/20 0.44
▸ RAB9A P51151 4/20 0.44
▸ NPC1 O15118 3/20 0.44
▸ MAPT P10636 8/20 0.43
▸ SMN1; SMN2 Q16637 2/20 0.43
▸ POLB P06746 2/20 0.43
▸ HTT P42858 1/20 0.43
▸ BLM P54132 1/20 0.43
▸ ALDH1A1 P00352 8/20 0.43
▸ HPGD P15428 3/20 0.43
▸ KDM4E B2RXH2 5/20 0.43
▸ MAPK1 P28482 3/20 0.43
▸ LMNA P02545 3/20 0.43
▸ CA12 O43570 1/20 0.43
▸ CA1 P00915 1/20 0.43
▸ CA2 P00918 1/20 0.43
▸ CA9 Q16790 1/20 0.43
▸ MAOB P27338 1/20 0.39
▸ S100A4 P26447 1/20 0.38

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
SCHEMBL28001227 0.82 MEN1 (0.58) MEN1KMT2ARAB9ANPC1MAPT
SCHEMBL14984890 0.81 MEN1 (0.55) MEN1KMT2ARAB9ANPC1MAPT
SCHEMBL28001177 0.81 MEN1 (0.55) MEN1KMT2ARAB9ANPC1MAPT
SCHEMBL14379236 0.79 MAPT (0.38) MEN1KMT2ARAB9ANPC1MAPT
SCHEMBL11410152 0.76 MAPT (0.51) MEN1KMT2ARAB9AMAPTSMN1; SMN2
SCHEMBL11410151 0.76 MAPT (0.51) MEN1KMT2ARAB9AMAPTSMN1; SMN2
SCHEMBL9849951 0.75 ALDH1A1 (0.50) MEN1KMT2ARAB9ANPC1MAPT
SCHEMBL27329385 0.74 LMNA (0.55) MEN1KMT2ARAB9ANPC1MAPT
SCHEMBL13811445 0.73 S100A4 (0.45) MEN1KMT2ARAB9AALDH1A1KDM4E
SCHEMBL9850054 0.72 ALDH1A1 (0.48) MEN1KMT2ARAB9ANPC1MAPT

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-0274858-A1 Toner compositions with inner salt charge enhancing additives XEROX CORPORATION (US) 1988-07-20 — — EP disclosed
US-4299903-A BUTYL METHACRYLATE-STYRENE OR BUTADIENE-STYRENE COPOLYMER MODIFIED WITH A QUATERNARY AMMONIUM COMPOUND XEROX CORPORATION (US) 1981-11-10 — — US disclosed
US-4035310-A STYRENE-VINYL, STYRENE-ACRYLATE COPOLYMERS XEROX CORPORATION (US) 1977-07-12 — — US disclosed
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