SCHEMBL1860910

SCHEMBL1860910

CC1CCCN1C(=O)CCCN

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SMYD3 Q9H7B4 3/20 0.43
HPGD P15428 2/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
CHRM2 P08172 1/20 0.41
CHRM4 P08173 1/20 0.41
CHRM1 P11229 1/20 0.41
CHRM3 P20309 1/20 0.41
NPC1 O15118 1/20 0.41
MEN1 O00255 1/20 0.41
POLB P06746 1/20 0.41
MAPT P10636 1/20 0.41
KMT2A Q03164 1/20 0.41
DPP4 P27487 1/20 0.40
PREP P48147 1/20 0.40
FAP Q12884 1/20 0.40
DPP8 Q6V1X1 1/20 0.40
DPP9 Q86TI2 1/20 0.40
GAA P10253 1/20 0.40

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
SCHEMBL1631030 0.89 CHRM2 (0.46) SMYD3HPGDSMN1; SMN2CHRM2CHRM4
SCHEMBL1630457 0.89 SMYD3 (0.47) SMYD3NPC1
SCHEMBL1632875 0.84 HPGD (0.43) HPGDSMN1; SMN2CHRM2CHRM4CHRM1
SCHEMBL21430305 0.83 NPC1 (0.44) HPGDSMN1; SMN2CHRM2CHRM4CHRM1
SCHEMBL1631843 0.82 DPP4 (0.58) SMYD3HPGDSMN1; SMN2CHRM2CHRM4
SCHEMBL8137653 0.82 DPP4 (0.58) SMYD3HPGDSMN1; SMN2CHRM2CHRM4
SCHEMBL30110380 0.81 L3MBTL1 (0.51) MEN1POLBMAPTKMT2A
SCHEMBL8012012 0.80 HPGD (0.45) HPGDSMN1; SMN2CHRM2CHRM4CHRM1
SCHEMBL11892759 0.80 HPGD (0.45) HPGDSMN1; SMN2CHRM2CHRM4CHRM1
SCHEMBL11892762 0.80 HPGD (0.45) HPGDSMN1; SMN2CHRM2CHRM4CHRM1

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-7939534-B2 e.g. (2-{[2-(3-fluorophenyl)ethyl]amino}-6-piperidyl(3-pyridyl))-N-(3-pyridylmethyl)carboxamide; smooth muscle myosin or non-muscle myosin modulator; hypotensive agent; asthma, chronic obstructive pulmonary disease, bronchoconstrictive disease, glaucoma, pre-menstrual cramps, erectile dysfunction CYTOKINETICS, INC. (US) 2011-05-10 US claimed