SCHEMBL30937652

SCHEMBL30937652

N[C@H]1COc2ccc(F)cc2C1

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ROCK2 O75116 5/20 0.39
MALT1 Q9UDY8 1/20 0.38
CYP19A1 P11511 1/20 0.38
CA2 P00918 1/20 0.38
NOS3 P29474 1/20 0.36
NOS2 P35228 1/20 0.36
TRPV1 Q8NER1 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
SCHEMBL21811008 1.00 ROCK2 (0.39) ROCK2MALT1CYP19A1CA2NOS3
Hydrochloric Acid SCHEMBL21810886 0.98 ROCK2 (0.38) ROCK2MALT1CYP19A1CA2NOS3
SCHEMBL21810881 0.79 HTR7 (0.35)
SCHEMBL3983842 0.79 KDM1A (0.40) MALT1CYP19A1CA2
SCHEMBL431457 0.79 HRH4 (0.39) ROCK2CYP19A1CA2
SCHEMBL21810889 0.79 HRH4 (0.39) ROCK2CYP19A1CA2
SCHEMBL21810882 0.79 HTR7 (0.35)
SCHEMBL16303421 0.79 MALT1 (0.40) ROCK2MALT1CYP19A1TRPV1
SCHEMBL23652982 0.78 AADAT (0.40)
SCHEMBL9692474 0.78 TRPV1 (0.46) ROCK2MALT1CYP19A1CA2TRPV1

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
EP-4594307-A1 1,4-DIHYDROQUINAZOLINONE COMPOUNDS AND USES THEREOF EDGEWISE THERAPEUTICS, INC. (US) 2025-08-06 EP disclosed
WO-2024073426-A1 1,4-DIHYDROQUINAZOLINONE COMPOUNDS AND USES THEREOF EDGEWISE THERAPEUTICS, INC. (US) 2024-04-04 WO disclosed