SCHEMBL5768942

SCHEMBL5768942

COCc1nc(N)c2ccncc2n1

nearest known ligand 0.38

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ LATS1 O95835 11/20 0.38
▸ LATS2 Q9NRM7 10/20 0.38
▸ KDM4C Q9H3R0 5/20 0.38
▸ ACHE P22303 1/20 0.37
▸ LMNA P02545 2/20 0.35
▸ CYP1A2 P05177 1/20 0.34
▸ CYP3A4 P08684 1/20 0.34
▸ CYP2D6 P10635 1/20 0.34
▸ CYP2C9 P11712 1/20 0.34
▸ CYP2C19 P33261 1/20 0.34
▸ CLK1 P49759 1/20 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
SCHEMBL250853 0.73 ACHE (0.42) LATS1LATS2KDM4CACHELMNA
SCHEMBL26157957 0.72 DCPS (0.55) ACHELMNACYP1A2CYP3A4CYP2D6
SCHEMBL29563950 0.72 LATS1 (0.33) LATS1LATS2KDM4CACHE
SCHEMBL5768328 0.69 HASPIN (0.46) LATS1LATS2KDM4CACHELMNA
SCHEMBL21875480 0.67 LATS1 (0.61) LATS1LATS2
SCHEMBL30007569 0.66 KDM5A (0.46) LATS1LATS2KDM4CACHELMNA
SCHEMBL22716441 0.66 DHFR (0.35) —
SCHEMBL20547728 0.66 LATS1 (0.43) LATS1LATS2KDM4CACHE
SCHEMBL29439842 0.66 DHFR (0.35) —
SCHEMBL25190902 0.65 LATS1 (0.54) LATS1LATS2KDM4C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2006118598-A1 BICYCLOHETEROARYLAMINE COMPOUNDS AS ION CHANNEL LIGANDS AND USES THEREOF RENOVIS, INC. (US) 2006-11-09 — — WO claimed
EP-1697361-A1 BICYCLOHETEROARYLAMINE COMPOUNDS AS ION CHANNEL LIGANDS AND USES THEREOF Renovis, Inc. (US) 2006-09-06 — — EP claimed
WO-2005066171-A1 BICYCLOHETEROARYLAMINE COMPOUNDS AS ION CHANNEL LIGANDS AND USES THEREOF RENOVIS, INC. (US) 2005-07-21 — — WO claimed
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