SCHEMBL7367538

SCHEMBL7367538

[CH2]CCCCCCCNCC(O)COc1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.62
KMT2A Q03164 2/20 0.62
OPRM1 P35372 1/20 0.62
OPRD1 P41143 1/20 0.62
LMNA P02545 1/20 0.58
ADRB1 P08588 7/20 0.55
ADRB3 P13945 7/20 0.55
ADRB2 P07550 2/20 0.55
CYP1A2 P05177 1/20 0.55
ATM Q13315 1/20 0.53
CYP2D6 P10635 2/20 0.52
MAPT P10636 1/20 0.50
HTT P42858 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50

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
SCHEMBL7364771 1.00 MEN1 (0.62) MEN1KMT2AOPRM1OPRD1LMNA
SCHEMBL7367855 0.99 MEN1 (0.63) MEN1KMT2AOPRM1OPRD1LMNA
SCHEMBL6690111 0.94 MEN1 (0.65) MEN1KMT2AOPRM1OPRD1LMNA
SCHEMBL7367871 0.87 MEN1 (0.63) MEN1KMT2AOPRM1OPRD1LMNA
SCHEMBL9014015 0.86 MEN1 (0.62) MEN1KMT2AOPRM1OPRD1LMNA
SCHEMBL7367965 0.85 ADRB3 (0.60) MEN1KMT2AOPRM1OPRD1LMNA
SCHEMBL7368932 0.85 CASR (0.51) MEN1KMT2AOPRM1OPRD1LMNA
SCHEMBL23612629 0.84 MEN1 (0.60) MEN1KMT2AOPRM1OPRD1LMNA
SCHEMBL7369310 0.84 KDM4E (0.62) KMT2AADRB1ADRB3ADRB2
SCHEMBL21775649 0.84 MEN1 (0.67) MEN1KMT2AOPRM1OPRD1LMNA

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
WO-1994002463-A1 ANTIHYPERTENSIVE 1,4-DIHYDROPYRIDINE DERIVATIVES AND PROCESS FOR THEIR PREPARATION FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1994-02-03 WO disclosed