SCHEMBL7285131

SCHEMBL7285131

CC(CCN)(c1ccccc1)c1ccc(F)cc1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 12/20 0.46
KCNN4 O15554 3/20 0.44
TAAR1 Q96RJ0 1/20 0.44
KCNE1 P15382 1/20 0.41
KCNQ1 P51787 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.40
MEN1 O00255 1/20 0.40
ALDH1A1 P00352 1/20 0.40
LMNA P02545 1/20 0.40
POLB P06746 1/20 0.40
KMT2A Q03164 1/20 0.40
KCNH2 Q12809 1/20 0.39
GAA P10253 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37

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
SCHEMBL7287874 0.92 TAAR1 (0.41) KIF11KCNN4TAAR1SMN1; SMN2MEN1
SCHEMBL5221334 0.88 TAAR1 (0.54) KIF11KCNN4TAAR1SMN1; SMN2KCNH2
SCHEMBL11569782 0.79 KIF11 (0.64) KIF11TAAR1SMN1; SMN2KCNH2
SCHEMBL17931724 0.79 KCNN4 (0.44) KIF11KCNN4TAAR1KCNE1KCNQ1
SCHEMBL8325626 0.77 KCNN4 (0.43) KIF11KCNN4TAAR1KCNE1KCNQ1
SCHEMBL19441058 0.76 TAAR1 (0.50) KIF11KCNN4TAAR1KCNE1KCNQ1
SCHEMBL5308364 0.76 LOXL2 (0.42) KIF11KCNN4TAAR1SMN1; SMN2MEN1
SCHEMBL25039132 0.73 KCNN4 (0.50) KIF11KCNN4TAAR1KCNE1KCNQ1
SCHEMBL16500593 0.73 ESR1 (0.60) KIF11KCNN4TAAR1KCNE1KCNQ1
SCHEMBL17931719 0.73 ESR1 (0.60) KIF11KCNN4KCNE1KCNQ1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0262448-B1 IMIDAZOLYLGUANIDINE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND MEDICINES CONTAINING THEM HEUMANN PHARMA GMBH & CO (DE) 1991-12-18 EP disclosed
US-4912119-A Cardiovascular disorders HEUMANN PHARMA GMBH & CO. (DE) 1990-03-27 US disclosed
EP-0262448-A1 Imidazolylguanidine derivatives, process for their preparation and medicines containing them HEUMANN PHARMA GMBH & CO (DE) 1988-04-06 EP disclosed