SCHEMBL9682069

SCHEMBL9682069

CN1CCC(Nc2nc3ccccc3n2Cc2ccccc2)C1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SSTR5 P35346 5/20 0.65
EED O75530 2/20 0.59
KCNH2 Q12809 7/20 0.57
NR4A2 P43354 2/20 0.55
LMNA P02545 3/20 0.55
CYP1A2 P05177 2/20 0.55
CYP2C19 P33261 2/20 0.55
GAA P10253 2/20 0.55
SMN1; SMN2 Q16637 2/20 0.55
MEN1 O00255 1/20 0.55
MLNR O43193 1/20 0.55
CACNA1F O60840 1/20 0.55
USP2 O75604 1/20 0.55
ABCB11 O95342 1/20 0.55
EGFR P00533 1/20 0.55
HLA-A P04439 1/20 0.55
ERBB2 P04626 1/20 0.55
TP53 P04637 1/20 0.55
LCK P06239 1/20 0.55
FYN P06241 1/20 0.55

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
SCHEMBL9681405 0.93 SSTR5 (0.71) SSTR5EEDKCNH2NR4A2LMNA
SCHEMBL9631290 0.91 SSTR5 (0.72) SSTR5EEDKCNH2NR4A2LMNA
Hydrochloric Acid SCHEMBL11271737 0.91 SSTR5 (0.68) SSTR5EEDKCNH2NR4A2LMNA
SCHEMBL9681479 0.87 ALDH1A1 (0.50) SSTR5EEDKCNH2LMNACYP1A2
SCHEMBL10529762 0.84 SSTR5 (0.78) SSTR5EEDKCNH2NR4A2LMNA
SCHEMBL11381151 0.83 SSTR5 (0.88) SSTR5EEDKCNH2NR4A2LMNA
SCHEMBL9629504 0.81 SSTR5 (0.59) SSTR5EEDKCNH2NR4A2LMNA
SCHEMBL9629452 0.81 SSTR5 (0.91) SSTR5EEDKCNH2NR4A2LMNA
Oxalic Acid SCHEMBL9630418 0.81 SSTR5 (0.45) SSTR5EEDKCNH2NR4A2LMNA
Oxalic Acid SCHEMBL9630409 0.81 SSTR5 (0.45) SSTR5EEDKCNH2NR4A2LMNA

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-5106857-A N-(1-methyl-3-pyrrolidinyl)-1-(phenylmethyl)-1H-benzimidazol-2-amine and analogs as antiarrhythmic and muscle relaxing agents A. H. ROBINS COMPANY, INCORPORATED (US) 1992-04-21 US claimed
US-5106857-A N-(1-methyl-3-pyrrolidinyl)-1-(phenylmethyl)-1H-benzimidazol-2-amine and analogs as antiarrhythmic and muscle relaxing agents A. H. ROBINS COMPANY, INCORPORATED (US) 1992-04-21 US disclosed
US-5106857-A N-(1-methyl-3-pyrrolidinyl)-1-(phenylmethyl)-1H-benzimidazol-2-amine and analogs as antiarrhythmic and muscle relaxing agents A. H. ROBINS COMPANY, INCORPORATED (US) 1992-04-21 US disclosed
US-5106857-A N-(1-methyl-3-pyrrolidinyl)-1-(phenylmethyl)-1H-benzimidazol-2-amine and analogs as antiarrhythmic and muscle relaxing agents A. H. ROBINS COMPANY, INCORPORATED (US) 1992-04-21 US disclosed