SCHEMBL25965941

SCHEMBL25965941

CC1(C)c2ccccc2-c2ccc3c(c21)c1ccccc1n3-c1cccc(-c2nc(-c3ccc(-c4ccccc4)cc3)nc(-c3cccc(-c4ccccc4)c3)n2)c1

nearest known ligand 0.38

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 1/20 0.33
RXFP1 Q9HBX9 1/20 0.31
PDK2 Q15119 1/20 0.30
HPSE Q9Y251 1/20 0.30

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
SCHEMBL25965772 0.99 PDE10A (0.33) PDE10ARXFP1
SCHEMBL25965717 0.98 RXFP1 (0.32) PDE10ARXFP1
SCHEMBL25966550 0.97 KDM4E (0.33) PDE10ARXFP1
SCHEMBL24217426 0.96 RXFP1 (0.33) PDE10ARXFP1
SCHEMBL25966553 0.95 KDM4E (0.34) PDE10ARXFP1
SCHEMBL19104550 0.95 RXRA (0.32) RXFP1PDK2
SCHEMBL25966451 0.95 KDM4E (0.34) PDE10ARXFP1
SCHEMBL24078205 0.94 KDM4E (0.31) PDE10ARXFP1
SCHEMBL25965995 0.94 KDM4E (0.31) PDE10ARXFP1
SCHEMBL25966454 0.94 KDM4E (0.35) RXFP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230255106-A1 ORGANIC ELECTROLUMINESCENT APPARATUS MERCK PATENT GMBH (DE) 2023-08-10 US disclosed
US-20230255106-A1 ORGANIC ELECTROLUMINESCENT APPARATUS MERCK PATENT GMBH (DE) 2023-08-10 US disclosed