SCHEMBL11713041

SCHEMBL11713041

CN1N=C(c2ccccc2O)CC1c1ccccc1

nearest known ligand 0.69

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 4/20 0.69
▸ KMT2A Q03164 4/20 0.69
▸ HSP90AA1 P07900 1/20 0.69
▸ ATM Q13315 1/20 0.69
▸ MAOB P27338 11/20 0.65
▸ MAOA P21397 11/20 0.65

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
SCHEMBL6297386 0.80 MAOB (0.49) MEN1KMT2AHSP90AA1ATMMAOB
SCHEMBL31429939 0.79 MAOB (1.00) MAOBMAOA
SCHEMBL28205313 0.78 MEN1 (0.64) MEN1KMT2AHSP90AA1ATMMAOB
SCHEMBL28205856 0.77 MEN1 (0.74) MEN1KMT2AHSP90AA1ATMMAOB
SCHEMBL6294117 0.77 PKM (0.50) MEN1KMT2AHSP90AA1ATMMAOB
SCHEMBL7456837 0.75 MAOB (0.73) MAOBMAOA
SCHEMBL6292699 0.75 ESD (0.75) MEN1KMT2AHSP90AA1ATMMAOB
SCHEMBL28205855 0.75 MEN1 (0.60) MEN1KMT2AHSP90AA1ATMMAOB
SCHEMBL14081504 0.74 MAOB (0.88) MAOBMAOA
SCHEMBL17454724 0.74 MAOB (0.82) MAOBMAOA

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-4014896-A Catalytic dehydrogenation process for the preparation of 3,4,5-trisubstituted pyrazoles AMERICAN CYANAMID COMPANY (US) 1977-03-29 — — US disclosed
US-3952010-A MULTISTAGE, FROM A KETONE AND AN ALDEHYDE, HYDRAZINE AMERICAN CYANAMID COMPANY (US) 1976-04-20 — — US disclosed
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