SCHEMBL9826808

SCHEMBL9826808

CCN(CCNC(=O)c1ccc(N)cc1)CCc1ccc(N)cc1

nearest known ligand 0.79

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.79
▸ LMNA P02545 2/20 0.79
▸ SLC22A2 O15244 1/20 0.79
▸ SLC22A1 O15245 1/20 0.79
▸ TSHR P16473 1/20 0.79
▸ ACHE P22303 1/20 0.79
▸ MAPK1 P28482 1/20 0.79
▸ CYP2C19 P33261 1/20 0.79
▸ BLM P54132 2/20 0.77
▸ PMP22 Q01453 1/20 0.77
▸ ESRRG P62508 4/20 0.58
▸ NFKB1 P19838 1/20 0.54
▸ KCNH2 Q12809 1/20 0.54
▸ POLB P06746 2/20 0.53
▸ CYP3A4 P08684 1/20 0.53
▸ THRB P10828 1/20 0.53
▸ ATM Q13315 1/20 0.53
▸ SMN1; SMN2 Q16637 1/20 0.53
▸ HDAC3 O15379 2/20 0.52
▸ HDAC4 P56524 2/20 0.52

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
Procainamide SCHEMBL15914 0.89 ALDH1A1 (1.00) ALDH1A1LMNASLC22A2SLC22A1TSHR
SCHEMBL15741421 0.87 ALDH1A1 (0.86) ALDH1A1LMNASLC22A2SLC22A1TSHR
Procainamide SCHEMBL40758 0.87 BLM (1.00) ALDH1A1LMNASLC22A2SLC22A1TSHR
Procainamide SCHEMBL28944214 0.87 ALDH1A1 (0.97) ALDH1A1LMNASLC22A2SLC22A1TSHR
Procainamide SCHEMBL9614531 0.87 BLM (1.00) ALDH1A1LMNASLC22A2SLC22A1TSHR
Procainamide SCHEMBL23270847 0.86 BLM (0.97) ALDH1A1LMNASLC22A2SLC22A1TSHR
Procainamide SCHEMBL9437783 0.86 BLM (0.97) ALDH1A1LMNASLC22A2SLC22A1TSHR
Procainamide SCHEMBL5443536 0.86 BLM (0.97) ALDH1A1LMNASLC22A2SLC22A1TSHR
Procainamide SCHEMBL9618624 0.86 BLM (0.97) ALDH1A1LMNASLC22A2SLC22A1TSHR
Procainamide SCHEMBL341750 0.86 ALDH1A1 (0.94) ALDH1A1LMNASLC22A2SLC22A1TSHR

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
EP-0285284-B1 N-PHENETHYLAMINOALKYL-BENZAMIDE ANTI-ARRHYTHMIA AGENTS Pfizer Limited (GB) 1991-05-15 — — EP disclosed
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