SCHEMBL9677359

SCHEMBL9677359

CN(CCc1ccc(N)cc1)Cc1cc2cc(N)ccc2o1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 1/20 0.46
GRK6 P43250 1/20 0.42
FLT3 P36888 1/20 0.41
SIGMAR1 Q99720 2/20 0.41
ROCK1 Q13464 1/20 0.38
CA2 P00918 1/20 0.36
F2 P00734 1/20 0.35
F10 P00742 1/20 0.35
SMN1; SMN2 Q16637 4/20 0.35
NPC1 O15118 4/20 0.35
MAPT P10636 3/20 0.35
RAB9A P51151 3/20 0.35
KDM4E B2RXH2 2/20 0.35
HSD17B10 Q99714 2/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C9 P11712 1/20 0.35
CYP2C19 P33261 1/20 0.35
GFER P55789 2/20 0.34

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
SCHEMBL9676280 0.89 SIGMAR1 (0.41) ACHEGRK6SIGMAR1ROCK1CA2
SCHEMBL2103952 0.79 FLT3 (0.50) ACHEFLT3CA2F2F10
SCHEMBL12708370 0.77 ACHE (0.41) ACHEFLT3CA2F2F10
SCHEMBL9676534 0.76 GRK6 (0.67) ACHEGRK6SIGMAR1ROCK1SMN1; SMN2
SCHEMBL9678236 0.76 CDC25C (0.51) ACHESIGMAR1CA2MEN1ALDH1A1
SCHEMBL9677439 0.74 KCNH2 (0.50) ACHESMN1; SMN2KDM4ECYP1A2CYP3A4
SCHEMBL12394347 0.74 PRKCI (0.47) ACHEFLT3CA2F2F10
SCHEMBL9675507 0.73 SIGMAR1 (0.41) ACHEGRK6SIGMAR1ROCK1CA2
SCHEMBL9627913 0.72 SIGMAR1 (0.66) SIGMAR1CYP1A2CYP3A4CYP2D6GFER
SCHEMBL8179634 0.71 TLR8 (0.47) ACHEGRK6FLT3CA2F2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0281254-B1 ANTIARRYTHMIC AGENTS Pfizer Limited (GB) 1990-01-17 EP claimed
EP-0281254-A1 Antiarrythmic agents Pfizer Limited (GB) 1988-09-07 EP claimed
US-5158964-A Benzoxazole sulfonamide anti-arrhythmic agents PFIZER INC. (US) 1992-10-27 US disclosed
US-5055473-A QUINOLINYL SULFONAMIDE ANTI-ARRHYTHMIC AGENTS AND USE THEREAS PFIZER INC. (US) 1991-10-08 US disclosed
US-4956382-A TERTIARY AMINE HETEROCYCLIC SULFONAMIDES PFIZER INC. (US) 1990-09-11 US disclosed
EP-0281254-B1 ANTIARRYTHMIC AGENTS Pfizer Limited (GB) 1990-01-17 EP disclosed
EP-0281254-A1 Antiarrythmic agents Pfizer Limited (GB) 1988-09-07 EP disclosed