SCHEMBL7003255

SCHEMBL7003255

CCCCCCCCCCCCCCCC(=O)NC1CCc2ccccc21

nearest known ligand 0.65

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.65
CA7 P43166 1/20 0.65
CA14 Q9ULX7 1/20 0.65
MEN1 O00255 1/20 0.58
KMT2A Q03164 1/20 0.58
DRD2 P14416 5/20 0.56
HTR1A P08908 3/20 0.56
ALDH1A1 P00352 2/20 0.56
TAOK1 Q7L7X3 5/20 0.55
TAOK3 Q9H2K8 4/20 0.55
SMN1; SMN2 Q16637 1/20 0.54
HTR7 P34969 1/20 0.53

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
SCHEMBL11450707 0.93 CA12 (0.58) CA12CA7CA14MEN1KMT2A
SCHEMBL11442868 0.93 CA12 (0.58) CA12CA7CA14MEN1KMT2A
SCHEMBL14335327 0.92 MEN1 (0.69) MEN1KMT2ADRD2HTR1AALDH1A1
SCHEMBL14336032 0.92 MEN1 (0.69) MEN1KMT2ADRD2HTR1AALDH1A1
SCHEMBL14376708 0.92 MEN1 (0.69) MEN1KMT2ADRD2HTR1AALDH1A1
SCHEMBL14376821 0.92 MEN1 (0.69) MEN1KMT2ADRD2HTR1AALDH1A1
SCHEMBL11178224 0.92 CA12 (0.57) CA12CA7CA14MEN1KMT2A
SCHEMBL11355077 0.92 CA12 (0.57) CA12CA7CA14MEN1KMT2A
SCHEMBL5969969 0.92 ALDH1A1 (0.61) MEN1KMT2ADRD2HTR1AALDH1A1
SCHEMBL5970025 0.92 ALDH1A1 (0.61) MEN1KMT2ADRD2HTR1AALDH1A1

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-1066039-A4 SUBSTITUTED QUINAZOLINES AND ANALOGS AND THE USE THEREOF COCENSYS INC (US) 2003-02-26 EP disclosed
EP-1066039-A1 SUBSTITUTED QUINAZOLINES AND ANALOGS AND THE USE THEREOF Cocensys, Inc. (US) 2001-01-10 EP disclosed
WO-1999044612-A1 SUBSTITUTED QUINAZOLINES AND ANALOGS AND THE USE THEREOF COCENSYS, INC. (US) 1999-09-10 WO disclosed