SCHEMBL7967911

SCHEMBL7967911

CC(=O)N1CCN(C2=Nc3ccc(F)cc3Nc3sc4ccccc4c32)CC1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 2/20 0.40
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
KDM4E B2RXH2 1/20 0.38
MAPT P10636 1/20 0.38
THRB P10828 1/20 0.38
PKM P14618 1/20 0.38
CASP1 P29466 1/20 0.38
KLK7 P49862 1/20 0.38
CASP7 P55210 1/20 0.38
CHRM2 P08172 2/20 0.37
CHRM4 P08173 2/20 0.37
CHRM5 P08912 2/20 0.37
ADRA2A P08913 2/20 0.37
CHRM1 P11229 2/20 0.37
DRD2 P14416 2/20 0.37
ADRA2B P18089 2/20 0.37
ADRA2C P18825 2/20 0.37
CHRM3 P20309 2/20 0.37
DRD1 P21728 2/20 0.37

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
SCHEMBL6995738 0.88 DTYMK (0.39)
SCHEMBL6990220 0.88 CHRM1 (0.49) MEN1KMT2ACHRM2CHRM4CHRM5
Maleic Acid SCHEMBL7669315 0.86 CHRM1 (0.43) MEN1KMT2AMAPTCHRM2CHRM4
SCHEMBL7002700 0.85 CHRM1 (0.38) MEN1KMT2ACHRM2CHRM4CHRM5
SCHEMBL6990191 0.85 CHRM1 (0.39) CHRM1HRH1
SCHEMBL6993039 0.84 DRD2 (0.47) MEN1KMT2AKDM4EMAPTCHRM2
SCHEMBL6999455 0.84 CHRM1 (0.46) MEN1KMT2ACHRM2CHRM4CHRM5
SCHEMBL8123379 0.84 HTR1A (0.37) MEN1KMT2ACHRM2CHRM4CHRM5
Maleic Acid SCHEMBL7665213 0.84 HTR2A (0.34) MEN1KMT2AKDM4EMAPTCHRM2
Maleic Acid SCHEMBL7666685 0.84 HRH4 (0.43) HTR2AHRH1

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
US-6271225-B1 PSYCHOLOGICAL DISORDERS WELFIDE CORPORATION (JP) 2001-08-07 US disclosed