SCHEMBL31465378

SCHEMBL31465378

Oc1cc(C(F)F)nc2ccnn12

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ PDE10A Q9Y233 1/20 0.41
▸ CCNT1 O60563 15/20 0.39
▸ CDK9 P50750 15/20 0.39
▸ PIK3CG P48736 1/20 0.39
▸ PDE2A O00408 1/20 0.38
▸ PDE3B Q13370 1/20 0.38
▸ CDK7 P50613 3/20 0.36
▸ CCNH P51946 3/20 0.36
▸ CDK4 P11802 3/20 0.36
▸ CCND1 P24385 3/20 0.36
▸ CDK2 P24941 2/20 0.36
▸ CCNA1 P78396 2/20 0.36
▸ CDK1 P06493 1/20 0.35
▸ CCNA2 P20248 1/20 0.35
▸ CCNE1 P24864 1/20 0.35
▸ CDK3 Q00526 1/20 0.35
▸ KCNN1 Q92952 1/20 0.34
▸ KCNN2 Q9H2S1 1/20 0.34
▸ KCNN3 Q9UGI6 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
SCHEMBL31465383 1.00 PDE10A (0.41) PDE10ACCNT1CDK9PIK3CGPDE2A
SCHEMBL31465366 0.81 CDK2 (0.43) PDE10ACCNT1CDK9PIK3CGPDE2A
SCHEMBL31465470 0.81 PDE10A (0.61) PDE10ACCNT1CDK9PIK3CGPDE2A
SCHEMBL16828091 0.74 PDE10A (0.43) PDE10ACCNT1CDK9CDK7CCNH
SCHEMBL4102510 0.74 PDE10A (0.43) PDE10ACCNT1CDK9PIK3CGPDE2A
SCHEMBL14545193 0.72 CCNT1 (0.54) CCNT1CDK9CDK7CCNHCDK4
SCHEMBL3338639 0.72 PDE10A (0.33) PDE10ACCNT1CDK9KCNN3
SCHEMBL7431490 0.70 PRKAB2 (0.54) PDE10ACCNT1CDK9CDK7CCNH
SCHEMBL31728547 0.70 PDE2A (0.40) PDE10APDE2APDE3B
SCHEMBL4253867 0.70 PIM1 (0.56) PDE10ACCNT1CDK9CDK2CCNA1

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-2025068090-A1 COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS THEREOF FOR THE TREATMENT OF DISEASES GALAPAGOS NV (BE) 2025-04-03 — — WO disclosed
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