SCHEMBL24704342

SCHEMBL24704342

C=C/C(=C\C)CN1CCNCC1

nearest known ligand 0.45

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CHRM5 P08912 2/20 0.44
CHRM3 P20309 2/20 0.44
SIGMAR1 Q99720 6/20 0.38
SMN1; SMN2 Q16637 2/20 0.32
HSD17B10 Q99714 1/20 0.32
POLB P06746 1/20 0.31
CXCR4 P61073 1/20 0.31

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
SCHEMBL26358219 0.80 CHRM5 (0.41) CHRM5CHRM3SIGMAR1SMN1; SMN2HSD17B10
SCHEMBL20037943 0.79 CHRM5 (0.35) CHRM5CHRM3
SCHEMBL21574025 0.76 KDM4E (0.44) SMN1; SMN2HSD17B10
SCHEMBL20037995 0.75 CHRM5 (0.35) CHRM5CHRM3SIGMAR1
SCHEMBL18970190 0.74 CHRM5 (0.40) CHRM5CHRM3SIGMAR1SMN1; SMN2HSD17B10
SCHEMBL7228712 0.74 CHRM5 (0.46) CHRM5CHRM3SIGMAR1SMN1; SMN2HSD17B10
SCHEMBL4364895 0.73 CHRM5 (0.50) CHRM5CHRM3SIGMAR1
SCHEMBL22110045 0.73
SCHEMBL22110185 0.73 KMT2A (0.35)
SCHEMBL20038018 0.72 MAPT (0.46) CHRM5CHRM3SIGMAR1SMN1; SMN2HSD17B10

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
EP-4098647-A1 DISUBSTITUTED ADAMANTYL DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF, AND PHARMACEUTICAL COMPOSITION FOR SUPPRESSING CANCER GROWTH COMPRISING SAME AS ACTIVE INGREDIENT Onecuregen Co., Ltd. (KR) 2022-12-07 EP disclosed