SCHEMBL23977210

SCHEMBL23977210

NC1CCc2cc(C(F)(F)F)ncc21

nearest known ligand 0.38

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ CYP11B1 P15538 4/20 0.38
▸ CYP11B2 P19099 4/20 0.38
▸ CA2 P00918 1/20 0.34
▸ CHKA P35790 1/20 0.34
▸ IRAK4 Q9NWZ3 1/20 0.33
▸ CHRNA7 P36544 1/20 0.32
▸ TRPV4 Q9HBA0 1/20 0.32
▸ LOXL2 Q9Y4K0 1/20 0.31

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
SCHEMBL31040816 1.00 CYP11B1 (0.38) CYP11B1CYP11B2CA2CHKAIRAK4
SCHEMBL31040771 0.76 PDPK1 (0.42) CA2CHKACHRNA7
SCHEMBL18818329 0.75 NOS3 (0.47) CHRNA7
Hydrochloric Acid SCHEMBL18794989 0.74 NOS3 (0.46) CHRNA7
SCHEMBL27894710 0.74 CHRNA7 (0.55) CYP11B1CYP11B2CHRNA7
SCHEMBL6845118 0.74 CHRNA7 (0.55) CYP11B1CYP11B2CHRNA7
Hydrochloric Acid SCHEMBL12983298 0.72 CHRNA7 (0.54) CHRNA7
Hydrochloric Acid SCHEMBL12983296 0.72 CHRNA7 (0.54) CHRNA7
Hydrochloric Acid SCHEMBL31696678 0.71 IDO1 (0.44) CYP11B1CYP11B2IRAK4LOXL2
SCHEMBL15086540 0.69 PNMT (0.53) CYP11B1CYP11B2

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-2021217508-A1 COMPOUNDS AND COMPOSITIONS FOR INHIBITING THE ACTIVITY OF HIF2α AND THEIR METHODS OF USE NOVARTIS AG (CH) 2021-11-04 — — WO disclosed
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