SCHEMBL10388024

SCHEMBL10388024

CN1CCCN(CCCOC(=O)Cl)CC1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 6/20 0.46
SLC29A1 Q99808 4/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
MEN1 O00255 2/20 0.46
LMNA P02545 2/20 0.46
KMT2A Q03164 2/20 0.46
CYP2D6 P10635 2/20 0.46
ABCC4 O15439 1/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2C9 P11712 1/20 0.46
TSHR P16473 1/20 0.46
CHRM3 P20309 1/20 0.46
HTR2A P28223 1/20 0.46
MAPK1 P28482 1/20 0.46
SLC6A4 P31645 1/20 0.46
CYP2C19 P33261 1/20 0.46
SCN1A P35498 1/20 0.46
THPO P40225 1/20 0.46
HTR2B P41595 1/20 0.46
MTOR P42345 1/20 0.46

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
SCHEMBL1301323 0.93 HRH3 (0.49) HRH3SLC29A1SMN1; SMN2MEN1LMNA
Hydrochloric Acid SCHEMBL1950623 0.92 HRH3 (0.48) HRH3SLC29A1SMN1; SMN2MEN1LMNA
SCHEMBL8560879 0.86 KDM4E (0.51) HRH3SMN1; SMN2MEN1KMT2ACYP2D6
Hydrochloric Acid SCHEMBL3107158 0.85 PAOX (0.53) HRH3SLC29A1MEN1KMT2ADRD3
SCHEMBL8562390 0.84 CYP2D6 (0.54) HRH3SMN1; SMN2MEN1KMT2ACYP2D6
SCHEMBL10387010 0.83 ALDH1A1 (0.49) HRH3SLC29A1MEN1KMT2ATSHR
SCHEMBL8568373 0.80 HRH3 (0.52) HRH3SMN1; SMN2MEN1KMT2AKCNH2
SCHEMBL29085663 0.78 PAOX (0.49) HRH3SLC29A1SMN1; SMN2MEN1LMNA
SCHEMBL16845085 0.78 HRH3 (0.50) HRH3SLC29A1SMN1; SMN2MEN1LMNA
SCHEMBL11025698 0.77 HRH3 (0.47) HRH3SLC29A1SMN1; SMN2MEN1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4958024-A REACTION OF CARBAMATE SUBSTITUTED ACRYLIC ESTER, VASODILATORS, HYPOTENSIVE AGENTS BANYU PHARMACEUTICAL COMPANY, LTD. (JP) 1990-09-18 US disclosed
US-4914227-A FOR VASODILATING AND HYPOTENSIVE AGENTS BANYU PHARMACEUTICAL COMPANY, LTD. (JP) 1990-04-03 US disclosed
US-4739106-A VASODILATION, HYPOTENSIVE AGENTS BANYU PHARMACEUTICAL CO., LTD. (JP) 1988-04-19 US disclosed
EP-0101023-A1 Process for preparing 2-carbamoyloxyalkyl-1,4-dihydropyridine derivatives and intermediates useful for the process BANYU PHARMACEUTICAL CO., LTD. (JP) 1984-02-22 EP disclosed