SCHEMBL30767487

SCHEMBL30767487

FC(F)c1ccc(-c2ccc(CCl)cc2)nc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 9/20 0.37
CYP11B2 P19099 9/20 0.37
RAB9A P51151 5/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
MAPT P10636 2/20 0.36
CASP3 P42574 1/20 0.36
SENP8 Q96LD8 1/20 0.36
SENP7 Q9BQF6 1/20 0.36
SENP6 Q9GZR1 1/20 0.36
NPC1 O15118 4/20 0.36
SMN1; SMN2 Q16637 4/20 0.36
NFKB1 P19838 1/20 0.36
MAPK1 P28482 1/20 0.36
NFKB2 Q00653 1/20 0.36
RELA Q04206 1/20 0.36
AURKA O14965 1/20 0.35
ABL1 P00519 1/20 0.35
NTRK1 P04629 1/20 0.35
LCK P06239 1/20 0.35
CSF1R P07333 1/20 0.35

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
SCHEMBL8239627 0.83 RAB9A (0.49) CYP11B1CYP11B2RAB9AL3MBTL1MAPT
SCHEMBL30767655 0.83 KDM1A (0.49) CYP11B1CYP11B2RAB9AMAPTNPC1
SCHEMBL31375485 0.83 RAB9A (0.39) CYP11B1CYP11B2RAB9AL3MBTL1MAPT
SCHEMBL30767657 0.80 MAPT (0.40) CYP11B1CYP11B2RAB9AL3MBTL1MAPT
SCHEMBL17610081 0.77 CYP11B1 (0.47) CYP11B1CYP11B2RAB9AL3MBTL1NPC1
SCHEMBL31375514 0.77 KDM1A (0.45) CYP11B1CYP11B2L3MBTL1AURKAABL1
SCHEMBL17092743 0.75 CA1 (0.38) L3MBTL1MAPK1ATM
SCHEMBL21035108 0.75 CNR2 (0.44) CYP11B1CYP11B2RAB9AL3MBTL1MAPT
SCHEMBL30767444 0.74 KIF11 (0.40) CYP11B1CYP11B2RAB9AL3MBTL1MAPT
SCHEMBL21035639 0.74 CYP11B1 (0.54) CYP11B1CYP11B2RAB9AL3MBTL1MAPT

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