SCHEMBL25070665

SCHEMBL25070665

Cc1nc2c(-c3ccc(-c4ccc(NC(C)C)cc4F)cc3)c3nsnc3c(-c3ccc(-c4ccc(NC(C)C)cc4F)cc3)c2nc1C

nearest known ligand 0.37

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ MAOB P27338 2/20 0.37
▸ PIM3 Q86V86 1/20 0.31
▸ LMNA P02545 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ HTT P42858 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ RPS6KA3 P51812 1/20 0.31
▸ PIM1 P11309 1/20 0.31
▸ CSNK2A1 P68400 1/20 0.31
▸ PIM2 Q9P1W9 1/20 0.31
▸ APEX1 P27695 1/20 0.30
▸ KIF11 P52732 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
SCHEMBL25070440 0.84 ESR1 (0.34) MAOB
SCHEMBL25070427 0.78 GCGR (0.37) MAOB
SCHEMBL25070535 0.77 PSMB5 (0.36) MAOBLMNAMAPTHTTSMN1; SMN2
SCHEMBL25070664 0.74 CRHR1 (0.32) —
SCHEMBL20176735 0.71 CRHR1 (0.34) —
SCHEMBL25070429 0.70 RARB (0.35) —
SCHEMBL20182372 0.70 HEXA (0.35) LMNA
SCHEMBL25070447 0.66 ESR1 (0.32) —
SCHEMBL13555451 0.66 BRD4 (0.40) LMNAMAPTHTTSMN1; SMN2
SCHEMBL20182250 0.66 ENPP1 (0.43) —

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
US-20230053362-A1 DICHROIC DYE COMPOSITION MERCK PATENT GMBH (DE) 2023-02-23 — — US disclosed
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