SCHEMBL9407476

SCHEMBL9407476

CC(CNCCN(C)C)CNCCN(C)C

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ANPEP P15144 1/20 0.48
CYP2C9 P11712 1/20 0.48
CYP2C19 P33261 1/20 0.48
PRMT3 O60678 1/20 0.43
CARM1 Q86X55 1/20 0.43
PRMT6 Q96LA8 1/20 0.43
PRMT1 Q99873 1/20 0.43
PRMT8 Q9NR22 1/20 0.43
ALDH1A1 P00352 2/20 0.34
TDP1 Q9NUW8 2/20 0.34
CA2 P00918 3/20 0.33
CA1 P00915 2/20 0.33
CA12 O43570 2/20 0.33
CA9 Q16790 2/20 0.33
SIGMAR1 Q99720 1/20 0.32
TERT O14746 1/20 0.31
TSHR P16473 1/20 0.30
CA3 P07451 1/20 0.30
CA4 P22748 1/20 0.30
CA6 P23280 1/20 0.30

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
SCHEMBL14888003 0.88 ANPEP (0.44) ANPEPCYP2C9CYP2C19PRMT3CARM1
SCHEMBL9407488 0.85 TDP1 (0.52) ANPEPCYP2C9CYP2C19PRMT3CARM1
SCHEMBL11413599 0.84 ANPEP (0.48) ANPEPCYP2C9CYP2C19PRMT3CARM1
SCHEMBL7759803 0.80 ANPEP (0.55) ANPEPCYP2C9CYP2C19PRMT3CARM1
SCHEMBL15832886 0.80 CYP2C9 (0.50) ANPEPCYP2C9CYP2C19PRMT3CARM1
SCHEMBL24401283 0.80 ANPEP (0.46) ANPEPCYP2C9CYP2C19PRMT3CARM1
SCHEMBL9407473 0.77 TDP1 (0.44) ANPEPCYP2C9CYP2C19ALDH1A1TDP1
SCHEMBL344526 0.76 CYP2C9 (0.72) ANPEPCYP2C9CYP2C19PRMT3CARM1
SCHEMBL13808509 0.75 ANPEP (0.42) ANPEPCYP2C9CYP2C19PRMT3CARM1
SCHEMBL11404495 0.75 ANPEP (0.42) ANPEPCYP2C9CYP2C19PRMT3CARM1

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-0590419-A1 Process for preparing unsaturated amines BASF Aktiengesellschaft (DE) 1994-04-06 EP disclosed