SCHEMBL23508690

SCHEMBL23508690

CCCC(C)(CCC)C(C)c1ccncc1C

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
LATS1 O95835 1/20 0.33
LATS2 Q9NRM7 1/20 0.33

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
SCHEMBL13028893 0.79 TRPA1 (0.33) LATS1LATS2
SCHEMBL13848825 0.72 TSHR (0.39) LATS1LATS2
SCHEMBL280624 0.72 TSHR (0.39) LATS1LATS2
SCHEMBL12512791 0.72 TSHR (0.39) LATS1LATS2
SCHEMBL2892375 0.71 GAA (0.41) LATS1LATS2
SCHEMBL2737302 0.70 RPS6KA3 (0.43) LATS1LATS2
SCHEMBL19133216 0.70 CYP1A2 (0.37) LATS1LATS2
SCHEMBL22043381 0.69 PRKCH (0.33) LATS1LATS2
SCHEMBL20693003 0.69 TRPA1 (0.36) LATS1LATS2
SCHEMBL19173619 0.68 KDM4E (0.38) LATS1LATS2

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
WO-2021115286-A1 SIX-MEMBERED AND FIVE-MEMBERED AROMATIC RING DERIVATIVE CONTAINING NITROGEN HETEROATOMS WHICH CAN BE USED AS SHP2 INHIBITOR 成都倍特药业股份有限公司 2021-06-17 WO disclosed