SCHEMBL10387010

SCHEMBL10387010

CN1CCN(CCOC(=O)Cl)CC1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.49
HRH3 Q9Y5N1 3/20 0.47
KDM4E B2RXH2 3/20 0.47
PAOX Q6QHF9 1/20 0.43
HTR1B P28222 1/20 0.42
RAB9A P51151 1/20 0.41
SLC29A1 Q99808 1/20 0.41
POLB P06746 2/20 0.40
TP53 P04637 1/20 0.40
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
RAD52 P43351 1/20 0.38
DRD3 P35462 1/20 0.38
TSHR P16473 1/20 0.38

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 0.89 HRH3 (0.49) ALDH1A1HRH3KDM4EPAOXRAB9A
Hydrochloric Acid SCHEMBL1950623 0.87 HRH3 (0.48) ALDH1A1HRH3KDM4EPAOXRAB9A
Hydrochloric Acid SCHEMBL3107158 0.84 PAOX (0.53) ALDH1A1HRH3KDM4EPAOXRAB9A
SCHEMBL8564311 0.83 KMT2A (0.49) ALDH1A1HRH3KDM4EHTR1BPOLB
SCHEMBL10388024 0.83 HRH3 (0.46) ALDH1A1HRH3KDM4EPAOXRAB9A
SCHEMBL17387575 0.82 ALDH1A1 (0.54) ALDH1A1HRH3KDM4EPAOXHTR1B
SCHEMBL11858444 0.82 SLC18A3 (0.51) ALDH1A1HRH3KDM4EPAOXHTR1B
SCHEMBL10386591 0.82 KMT2A (0.51) ALDH1A1KDM4EPOLBMEN1KMT2A
SCHEMBL11027681 0.81 ALDH1A1 (0.47) ALDH1A1HRH3KDM4EPAOXHTR1B
SCHEMBL9980789 0.80 ALDH1A1 (0.49) ALDH1A1HRH3KDM4EPAOXHTR1B

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 5 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-B1 PROCESS FOR PREPARING 2-CARBAMOYLOXYALKYL-1,4-DIHYDROPYRIDINE DERIVATIVES AND INTERMEDIATES USEFUL FOR THE PROCESS BANYU PHARMACEUTICAL CO., LTD. (JP) 1987-07-29 EP 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