SCHEMBL30153136

SCHEMBL30153136

COC(=O)c1cc(C(F)(F)F)c2oc(-c3cccc(-c4ccccc4-c4nncn4C)c3)nc2c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CETP P11597 2/20 0.38
▸ SMN1; SMN2 Q16637 3/20 0.37
▸ CLK1 P49759 1/20 0.37
▸ SCN9A Q15858 1/20 0.36
▸ MAPT P10636 3/20 0.36
▸ TP53 P04637 1/20 0.36
▸ CBLB Q13191 2/20 0.36
▸ NPC1 O15118 3/20 0.35
▸ RAB9A P51151 3/20 0.35
▸ HPGD P15428 4/20 0.35
▸ KDM4E B2RXH2 2/20 0.35
▸ ALDH1A1 P00352 2/20 0.35
▸ HSD17B10 Q99714 2/20 0.35
▸ S1PR1 P21453 3/20 0.34
▸ S1PR3 Q99500 2/20 0.34
▸ GPR119 Q8TDV5 1/20 0.34
▸ TOP2A P11388 1/20 0.34
▸ ESR2 Q92731 1/20 0.34
▸ NFKB1 P19838 1/20 0.34
▸ NFKB2 Q00653 1/20 0.34

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
SCHEMBL24819809 1.00 CETP (0.38) CETPSMN1; SMN2CLK1SCN9AMAPT
SCHEMBL30153040 0.92 HPGD (0.37) CETPSMN1; SMN2CLK1SCN9AMAPT
SCHEMBL30792096 0.92 HPGD (0.37) CETPSMN1; SMN2CLK1SCN9AMAPT
SCHEMBL24818673 0.92 HPGD (0.37) CETPSMN1; SMN2CLK1SCN9AMAPT
SCHEMBL24818728 0.91 SCN9A (0.38) CETPSCN9AMAPTTP53CBLB
SCHEMBL30153353 0.91 SCN9A (0.38) CETPSCN9AMAPTTP53CBLB
SCHEMBL24820064 0.87 HPGD (0.37) CETPSMN1; SMN2CLK1MAPTTP53
SCHEMBL30153029 0.87 HPGD (0.37) CETPSMN1; SMN2CLK1MAPTTP53
SCHEMBL30963777 0.87 CETP (0.35) CETPSMN1; SMN2CLK1MAPTCBLB
SCHEMBL24821895 0.86 HPGD (0.37) CETPSMN1; SMN2CLK1MAPTTP53

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-4359381-A1 CBL-B MODULATORS AND USES THEREOF Nimbus Clio, Inc. (US) 2024-05-01 — — EP disclosed
WO-2022272248-A1 CBL-B MODULATORS AND USES THEREOF NIMBUS CLIO, INC. (US) 2022-12-29 — — WO disclosed
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