SCHEMBL8328965

SCHEMBL8328965

CN1Cc2ccc3c(c2C1)NC(=O)/C3=N\O

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.30
POLB P06746 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
SCHEMBL8328966 1.00 ALDH1A1 (0.30) ALDH1A1POLB
SCHEMBL8325697 0.88 MAOA (0.34) ALDH1A1
SCHEMBL8325695 0.88 MAOA (0.34) ALDH1A1
SCHEMBL8329012 0.83 ALDH1A1 (0.31) ALDH1A1
SCHEMBL8329016 0.83 ALDH1A1 (0.31) ALDH1A1
SCHEMBL8330989 0.83
SCHEMBL8330987 0.83
SCHEMBL8331250 0.83 PNMT (0.30)
SCHEMBL8331247 0.83 PNMT (0.30)
SCHEMBL8327753 0.81 CES1 (0.42) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0529636-B1 Novel isatinoxime derivatives, their preparation and use NEUROSEARCH AS (DK) 1999-06-23 EP disclosed
US-5436250-A Isatineoxime derivatives, their preparation and use NEUROSEARCH A/S (DK) 1995-07-25 US disclosed
US-5242918-A Isatinoxime derivatives, their preparation and use NEUROSEARCH A/S (DK) 1993-09-07 US disclosed
WO-1993005043-A1 NOVEL ISATINOXIME DERIVATIVES, THEIR PREPARATION AND USE NEUROSEARCH A/S (DK) 1993-03-18 WO disclosed
EP-0529636-A1 Novel isatinoxime derivatives, their preparation and use NEUROSEARCH A/S (DK) 1993-03-03 EP disclosed