SCHEMBL30767657

SCHEMBL30767657

FC(F)Oc1ccc(-c2ccc(CCl)cc2)nc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.40
RAB9A P51151 3/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
CASP3 P42574 1/20 0.40
SENP8 Q96LD8 1/20 0.40
SENP7 Q9BQF6 1/20 0.40
SENP6 Q9GZR1 1/20 0.40
ALKBH1 Q13686 1/20 0.37
CYP11B1 P15538 2/20 0.36
PTGES O14684 3/20 0.35
TP53 P04637 1/20 0.35
DRD1 P21728 1/20 0.35
CNR2 P34972 1/20 0.35
CYP11B2 P19099 1/20 0.34
THRB P10828 2/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
SMN1; SMN2 Q16637 3/20 0.33
NPC1 O15118 2/20 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
SCHEMBL31375546 0.85 RAB9A (0.40) MAPTRAB9AL3MBTL1CASP3SENP8
SCHEMBL31664992 0.85 KDM1A (0.46) MAPTRAB9AL3MBTL1CASP3SENP8
SCHEMBL21816559 0.82 RAB9A (0.50) MAPTRAB9AL3MBTL1CASP3SENP8
SCHEMBL30767487 0.80 CYP11B1 (0.37) MAPTRAB9AL3MBTL1CASP3SENP8
SCHEMBL31375571 0.80 CHRNA7 (0.46) MAPTRAB9AL3MBTL1CASP3SENP8
SCHEMBL21816578 0.79 RAB9A (0.43) MAPTRAB9AL3MBTL1CASP3SENP8
SCHEMBL21816554 0.79 MAPT (0.43) MAPTRAB9AL3MBTL1CASP3SENP8
SCHEMBL21816553 0.79 RAB9A (0.43) MAPTRAB9AL3MBTL1CASP3SENP8
SCHEMBL9061973 0.79 RAB9A (0.52) MAPTRAB9AL3MBTL1CASP3SENP8
Hydrochloric Acid SCHEMBL30767633 0.79 CHRM5 (0.43) MAPTRAB9AL3MBTL1CASP3SENP8

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-4568960-A1 BICYCLIC TETRAHYDROAZEPINE DERIVATIVES F. Hoffmann-La Roche AG (CH) 2025-06-18 EP disclosed
WO-2024033458-A1 BICYCLIC TETRAHYDROAZEPINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2024-02-15 WO disclosed