SCHEMBL31375899

SCHEMBL31375899

Nc1cc(-c2ccncn2)nc2cnccc12

nearest known ligand 0.59

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LATS1 O95835 11/20 0.59
LATS2 Q9NRM7 8/20 0.59
CYP3A4 P08684 3/20 0.40
ACHE P22303 2/20 0.39
KDM4E B2RXH2 1/20 0.38
POLB P06746 1/20 0.38
HTT P42858 1/20 0.38
RAD52 P43351 1/20 0.38
LMNA P02545 1/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
HSP90AA1 P07900 1/20 0.36
IMPDH2 P12268 1/20 0.36

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
SCHEMBL4251618 0.83 ACHE (0.45) LATS1LATS2CYP3A4ACHEKDM4E
SCHEMBL20574285 0.81 LATS1 (0.59) LATS1LATS2CYP3A4
SCHEMBL29650635 0.79 LATS1 (0.56) LATS1LATS2ACHE
SCHEMBL4246335 0.76 ACHE (0.70) LATS1LATS2ACHEKDM4EPOLB
SCHEMBL30309302 0.75 LATS1 (1.00) LATS1LATS2
SCHEMBL26177174 0.75 LATS1 (1.00) LATS1LATS2
SCHEMBL14006433 0.75 CCR1 (0.53) LATS1LATS2CYP3A4CYP1A2CYP2D6
SCHEMBL31375158 0.74 LATS1 (0.60) LATS1LATS2ACHEIMPDH2
SCHEMBL31375147 0.74 LATS1 (0.60) LATS1LATS2ACHE
SCHEMBL20547736 0.73 GABRG2 (0.43) LATS1LATS2CYP3A4ACHEKDM4E

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
CN-114621222-B 6-6 Fused bicyclic heteroaryl compounds and their use as LATS inhibitors 诺华股份有限公司 2024-12-17 CN disclosed