SCHEMBL7155342

SCHEMBL7155342

CCC(CCN1CCCCC1)c1ccccc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.55
KMT2A Q03164 1/20 0.55
ALDH1A1 P00352 1/20 0.50
SIGMAR1 Q99720 1/20 0.47
CHRNA7 P36544 1/20 0.47
SLC6A3 Q01959 2/20 0.44
CYP1A2 P05177 1/20 0.44
CYP3A4 P08684 1/20 0.44
CYP2D6 P10635 1/20 0.44
TSHR P16473 1/20 0.44
CYP2C19 P33261 1/20 0.44
HIF1A Q16665 1/20 0.44
SLC22A1 O15245 1/20 0.44
CHRM2 P08172 1/20 0.44
HTR1A P08908 1/20 0.44
ADRA2A P08913 1/20 0.44
CHRM1 P11229 1/20 0.44
DRD1 P21728 1/20 0.44
TBXA2R P21731 1/20 0.44
SLC6A2 P23975 1/20 0.44

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
SCHEMBL7170813 0.98 MEN1 (0.56) MEN1KMT2AALDH1A1SIGMAR1CHRNA7
SCHEMBL4741508 0.83 MEN1 (0.55) MEN1KMT2AALDH1A1SIGMAR1CHRNA7
SCHEMBL7790826 0.83 ALDH1A1 (0.46) MEN1KMT2AALDH1A1CYP1A2CYP3A4
SCHEMBL11927945 0.81 ALDH1A1 (0.47) MEN1KMT2AALDH1A1CYP3A4CYP2D6
Prozapine SCHEMBL25765 0.80 ALDH1A1 (0.66) ALDH1A1SIGMAR1SLC6A3CYP2D6
Fenpiprane SCHEMBL24507 0.80 ALDH1A1 (0.66) ALDH1A1SIGMAR1SLC6A3CYP2D6
SCHEMBL17755099 0.80 ALDH1A1 (0.50) KMT2AALDH1A1SIGMAR1CHRNA7
SCHEMBL24102179 0.80 ALDH1A1 (0.47) KMT2AALDH1A1SIGMAR1CHRNA7CYP1A2
SCHEMBL8777949 0.79 ALDH1A1 (0.54) ALDH1A1SIGMAR1
Prozapine SCHEMBL365642 0.79 ALDH1A1 (0.64) MEN1KMT2AALDH1A1SIGMAR1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2003238530-A N-(CYCLOPROPYLMETHYL)AZACYCLOALKANE, COMPOSITION CONTAINING THE SAME AND METHOD FOR PRODUCING THE SAME WARNER LAMBERT CO LLC 2003-08-27 JP disclosed