SCHEMBL22687939

SCHEMBL22687939

C=C1CCC(n2c(C)nc3cc(F)cc(NC)c3c2=O)C(=O)N1

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ DDB1 Q16531 2/20 0.45
▸ CRBN Q96SW2 2/20 0.45
▸ TNF P01375 1/20 0.45
▸ IL1B P01584 1/20 0.45
▸ IKZF3 Q9UKT9 1/20 0.45
▸ P2RX7 Q99572 14/20 0.32
▸ JAK2 O60674 1/20 0.32
▸ JAK3 P52333 1/20 0.32
▸ RIPK1 Q13546 1/20 0.32
▸ CYP1A2 P05177 2/20 0.30
▸ CYP3A4 P08684 2/20 0.30
▸ CYP2C9 P11712 2/20 0.30
▸ TSHR P16473 2/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ MAPK1 P28482 1/20 0.30
▸ HSD17B10 Q99714 1/20 0.30

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
SCHEMBL21671655 0.90 CRBN (0.56) DDB1CRBNTNFIL1BIKZF3
SCHEMBL21671654 0.90 CRBN (0.56) DDB1CRBNTNFIL1BIKZF3
SCHEMBL21671659 0.79 CRBN (0.53) DDB1CRBNTNFIL1BIKZF3
SCHEMBL21671658 0.79 CRBN (0.53) DDB1CRBNTNFIL1BIKZF3
SCHEMBL21671784 0.78 CRBN (0.52) DDB1CRBNTNFIL1BIKZF3
SCHEMBL21671783 0.78 CRBN (0.52) DDB1CRBNTNFIL1BIKZF3
SCHEMBL25477252 0.75 DDB1 (0.56) DDB1CRBNTNFIL1BIKZF3
SCHEMBL21671662 0.75 CRBN (0.58) DDB1CRBNTNFIL1BIKZF3
SCHEMBL21671635 0.75 CRBN (0.58) DDB1CRBNTNFIL1BIKZF3
SCHEMBL21671752 0.75 CRBN (0.70) DDB1CRBNTNFIL1BIKZF3

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
EP-3404024-B1 QUINAZOLINONE DERIVATIVE, PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION, AND APPLICATIONS KANGPU BIOPHARMACEUTICALS LTD (CN) 2020-11-18 — — EP disclosed
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