SCHEMBL7307710

SCHEMBL7307710

CN(c1ccc2c(c1)CCC(=O)N2)C1CCN(Cc2ccccc2)CC1

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.50
▸ KMT2A Q03164 1/20 0.50
▸ ACHE P22303 2/20 0.49
▸ BCHE P06276 1/20 0.49
▸ MAOA P21397 7/20 0.48
▸ MAOB P27338 7/20 0.48
▸ NPY2R P49146 2/20 0.48
▸ PARP1 P09874 1/20 0.46
▸ CHRM2 P08172 1/20 0.43
▸ CHRM3 P20309 1/20 0.43
▸ OPRM1 P35372 1/20 0.43
▸ SIGMAR1 Q99720 1/20 0.43

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
SCHEMBL7366835 0.86 NPY2R (0.49) LMNAKMT2AACHEBCHEMAOA
Hydrochloric Acid SCHEMBL7292922 0.85 CHRM2 (0.59) LMNAKMT2ANPY2RCHRM2CHRM3
SCHEMBL7318685 0.84 GRIN2B (0.49) LMNAKMT2ANPY2RCHRM3
Hydrochloric Acid SCHEMBL7307989 0.83 GRIN2B (0.49) LMNAKMT2ACHRM3
Hydrochloric Acid SCHEMBL7309309 0.82 KDM1A (0.42) KMT2AMAOAMAOB
Hydrochloric Acid SCHEMBL7370551 0.82 TSHR (0.40) MAOAMAOBPARP1
Hydrochloric Acid SCHEMBL7371616 0.80 HTR1A (0.47) LMNAPARP1OPRM1
SCHEMBL9312162 0.77 CYP1A2 (0.45) —
SCHEMBL7374128 0.77 LMNA (0.58) LMNAKMT2AACHEBCHEMAOA
SCHEMBL21375648 0.75 SIGMAR1 (0.60) LMNAKMT2AACHECHRM2CHRM3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0255134-B1 CARBOSTYRIL DERIVATIVES AND SALTS THEREOF, PROCESS FOR PREPARING THEM, AND CARDIOTONIC COMPOSITION CONTAINING SAME OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1993-03-03 — — EP claimed
EP-0255134-A2 Carbostyril derivatives and salts thereof, process for preparing them, and cardiotonic composition containing same OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1988-02-03 — — EP disclosed
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