SCHEMBL16181815

SCHEMBL16181815

CNCC(O)CN1CCCCC1

nearest known ligand 0.64

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.64
KMT2A Q03164 1/20 0.64
CARM1 Q86X55 10/20 0.57
ATM Q13315 2/20 0.54
MAPT P10636 1/20 0.54
HTT P42858 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
PRMT6 Q96LA8 2/20 0.49
HSD17B10 Q99714 2/20 0.48
RECQL P46063 1/20 0.46
CYP2D6 P10635 1/20 0.43
CYP2C19 P33261 1/20 0.43
KDM4E B2RXH2 1/20 0.42
POLB P06746 1/20 0.42
PRMT1 Q99873 1/20 0.42

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
SCHEMBL488349 0.98 MEN1 (0.60) MEN1KMT2ACARM1ATMMAPT
SCHEMBL4333351 0.98 MEN1 (0.60) MEN1KMT2ACARM1ATMMAPT
SCHEMBL4331083 0.98 MEN1 (0.60) MEN1KMT2ACARM1ATMMAPT
SCHEMBL3967935 0.82 CARM1 (0.60) MEN1KMT2ACARM1HTTSMN1; SMN2
SCHEMBL4488790 0.80 USP2 (0.67) CARM1ATMSMN1; SMN2PRMT6HSD17B10
SCHEMBL13043937 0.80 CARM1 (0.54) MEN1KMT2ACARM1ATMMAPT
SCHEMBL3738380 0.80 CARM1 (0.54) MEN1KMT2ACARM1ATMMAPT
SCHEMBL4482944 0.80 USP2 (0.67) CARM1ATMSMN1; SMN2PRMT6HSD17B10
SCHEMBL4482950 0.80 USP2 (0.67) CARM1ATMSMN1; SMN2PRMT6HSD17B10
SCHEMBL11118757 0.79 MEN1 (1.00) MEN1KMT2AATMMAPTHTT

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-2643332-B1 METHOD FOR BUFFERING A CHEMICAL OR BIOLOGICAL COMPOSITION SACHEM INC (US) 2014-10-22 EP disclosed