SCHEMBL11099873

SCHEMBL11099873

CN1CCC(Nc2ccccc2OCc2ccccc2)CC1

nearest known ligand 0.58

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ HTR6 P50406 2/20 0.49
▸ HTR2C P28335 1/20 0.49
▸ HTR2B P41595 1/20 0.49
▸ GAA P10253 2/20 0.48
▸ ALDH1A1 P00352 1/20 0.48
▸ HSD17B10 Q99714 1/20 0.48
▸ BRD4 O60885 2/20 0.48
▸ EHMT2 Q96KQ7 2/20 0.48
▸ NSD2 O96028 1/20 0.47
▸ KDM4E B2RXH2 1/20 0.45
▸ MEN1 O00255 1/20 0.45
▸ KMT2A Q03164 1/20 0.45
▸ CHRNA7 P36544 2/20 0.44
▸ DRD2 P14416 1/20 0.44
▸ KDM1A O60341 1/20 0.43
▸ RCOR1 Q9UKL0 1/20 0.43

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
SCHEMBL2486964 0.87 BRD4 (0.53) ALDH1A1BRD4MEN1KMT2ADRD2
SCHEMBL21460278 0.76 SLC6A4 (0.53) HTR2CHTR2BALDH1A1BRD4MEN1
SCHEMBL24260258 0.74 KDM4E (0.49) KDM4EMEN1KMT2ADRD2
SCHEMBL3715263 0.73 BCHE (0.55) HTR6HTR2CHTR2BALDH1A1EHMT2
SCHEMBL8487979 0.73 ACHE (0.69) GAAALDH1A1HSD17B10EHMT2NSD2
SCHEMBL3715268 0.72 ACHE (0.47) HTR6HTR2CHTR2BALDH1A1KDM4E
SCHEMBL26268468 0.71 POLB (0.49) HTR2CGAAALDH1A1BRD4NSD2
SCHEMBL14783954 0.71 HRH3 (0.47) EHMT2MEN1KMT2A
SCHEMBL24260259 0.71 SSTR4 (0.46) KDM4EMEN1KMT2ADRD2
SCHEMBL29227078 0.71 KMT2A (0.50) HTR6HTR2CHTR2BGAAALDH1A1

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-0026469-B1 DIBENZAZEPINE DERIVATIVES, THEIR PRODUCTION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SANDOZ AG (CH) 1984-11-28 — — EP disclosed
US-4360525-A NEUROLEPTIC AGENTS, ANTIDEPRESSANTS, SLEEP PROMOTERS SANDOZ LTD. (CH) 1982-11-23 — — US disclosed
EP-0026469-A1 Dibenzazepine derivatives, their production and pharmaceutical compositions containing them SANDOZ AG (CH) 1981-04-08 — — EP disclosed
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