SCHEMBL11311366

SCHEMBL11311366

CN1C[C@@H](OC(=O)c2ccccc2)C[C@@H](c2ccccc2)C1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.56
KMT2A Q03164 1/20 0.56
CHRNA7 P36544 3/20 0.55
HTR3E A5X5Y0 1/20 0.55
HTR3B O95264 1/20 0.55
HTR3A P46098 1/20 0.55
HTR3D Q70Z44 1/20 0.55
HTR3C Q8WXA8 1/20 0.55
CHRM4 P08173 2/20 0.50
CHRM3 P20309 2/20 0.50
SCN1A P35498 1/20 0.49
SCN2A Q99250 1/20 0.49
SCN3A Q9NY46 1/20 0.49
APOBEC3A P31941 1/20 0.47
APOBEC3G Q9HC16 1/20 0.47
GAA P10253 1/20 0.46
SLC18A3 Q16572 1/20 0.45
CARM1 Q86X55 1/20 0.45
PRMT6 Q96LA8 1/20 0.45
TSHR P16473 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
SCHEMBL11311359 1.00 MEN1 (0.56) MEN1KMT2ACHRNA7HTR3EHTR3B
SCHEMBL11311356 1.00 MEN1 (0.56) MEN1KMT2ACHRNA7HTR3EHTR3B
SCHEMBL11321796 0.86 CHRM4 (0.52) MEN1KMT2ACHRM4CHRM3SLC18A3
SCHEMBL11321790 0.86 CHRM4 (0.52) MEN1KMT2ACHRM4CHRM3SLC18A3
SCHEMBL11321792 0.86 CHRM4 (0.52) MEN1KMT2ACHRM4CHRM3SLC18A3
SCHEMBL28593173 0.84 CHRM4 (0.51) MEN1KMT2ACHRM4CHRM3CHRM1
SCHEMBL1623587 0.82 CHRNA7 (0.61) MEN1KMT2ACHRNA7HTR3EHTR3B
SCHEMBL1623586 0.82 CHRNA7 (0.61) MEN1KMT2ACHRNA7HTR3EHTR3B
SCHEMBL11313992 0.77 CHRM4 (0.44) CHRM4CHRM3
SCHEMBL11313995 0.77 CHRM4 (0.44) CHRM4CHRM3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4248876-A Piperidine derivatives JOHN WYETH & BROTHER LTD. (GB) 1981-02-03 US claimed
US-4248876-A Piperidine derivatives JOHN WYETH & BROTHER LTD. (GB) 1981-02-03 US disclosed