SCHEMBL7721376

SCHEMBL7721376

N#Cc1cccc(N=Nc2ccccc2)c1C#N

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAOA P21397 3/20 0.51
▸ MAOB P27338 3/20 0.51
▸ ALDH1A1 P00352 4/20 0.43
▸ MEN1 O00255 5/20 0.41
▸ KMT2A Q03164 5/20 0.41
▸ SMN1; SMN2 Q16637 3/20 0.41
▸ MAPT P10636 3/20 0.41
▸ HIF1A Q16665 2/20 0.40
▸ LMNA P02545 2/20 0.38
▸ CASP3 P42574 1/20 0.38
▸ SENP8 Q96LD8 1/20 0.38
▸ SENP7 Q9BQF6 1/20 0.38
▸ SENP6 Q9GZR1 1/20 0.38
▸ RPS6KA3 P51812 1/20 0.37
▸ MAPK1 P28482 3/20 0.36
▸ TDP1 Q9NUW8 3/20 0.36
▸ NPC1 O15118 2/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ TSHR P16473 2/20 0.35
▸ PKM P14618 1/20 0.35

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
SCHEMBL13858679 0.89 ALDH1A1 (0.50) MAOAMAOBALDH1A1MEN1KMT2A
SCHEMBL1902205 0.89 ALDH1A1 (0.50) MAOAMAOBALDH1A1MEN1KMT2A
SCHEMBL6811922 0.81 MEN1 (0.45) MAOAMAOBALDH1A1MEN1KMT2A
SCHEMBL4456223 0.78 SMN1; SMN2 (0.56) MAOAMAOBALDH1A1MEN1KMT2A
SCHEMBL31473075 0.78 SMN1; SMN2 (0.56) MAOAMAOBALDH1A1MEN1KMT2A
SCHEMBL9007093 0.75 MEN1 (0.53) MAOAMAOBMEN1KMT2ASMN1; SMN2
SCHEMBL9007097 0.75 MEN1 (0.53) MAOAMAOBMEN1KMT2ASMN1; SMN2
SCHEMBL9861890 0.75 ALDH1A1 (0.43) ALDH1A1MEN1KMT2ASMN1; SMN2MAPT
SCHEMBL9861889 0.75 ALDH1A1 (0.43) ALDH1A1MEN1KMT2ASMN1; SMN2MAPT
SCHEMBL9422695 0.75 MAOA (0.46) MAOAMAOBALDH1A1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6441113-B1 HOMOPOLYMER OF A (METH)ACRYLATE ESTER OF AN AZOBENZENE-CONTAINING TRINUCLEAR GROUP OF GIVEN FORMULA; HIGH LEVEL OF BIREFRINGENCE INDUCED BY IRRADIATION; USE IN STORAGE OF OPTICAL INFORMATION BAYER AKTIENGESELLSCHAFT (DE) 2002-08-27 — — US disclosed
US-6423799-B1 IRRADIATION BAYER AG (DE) 2002-07-23 — — US disclosed
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