SCHEMBL30624488

SCHEMBL30624488

Cc1cc(C(C)(C)C)c(Cl)cc1-c1cc(=O)c(-c2cccnc2C(N)=O)c(C)[nH]1

nearest known ligand 0.33

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ EIF4E P06730 1/20 0.33
▸ BRD4 O60885 4/20 0.33
▸ GRM4 Q14833 1/20 0.32
▸ HPGD P15428 2/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ RAB9A P51151 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.31
▸ TP53 P04637 1/20 0.31
▸ GAA P10253 1/20 0.31
▸ NPSR1 Q6W5P4 1/20 0.31
▸ HSD17B10 Q99714 1/20 0.31
▸ KIT P10721 2/20 0.30
▸ BTK Q06187 1/20 0.30
▸ CTRC Q99895 1/20 0.30
▸ METAP2 P50579 1/20 0.30
▸ DRD1 P21728 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
SCHEMBL26602270 0.84 JAK2 (0.31) —
SCHEMBL26602678 0.81 KDM5B (0.33) BRD4
SCHEMBL30624550 0.80 KMO (0.35) —
SCHEMBL26601926 0.80 KMO (0.35) —
SCHEMBL26606968 0.80 JAK2 (0.31) —
SCHEMBL26601855 0.79 SCN9A (0.36) BRD4
SCHEMBL30624548 0.79 JAK2 (0.31) —
SCHEMBL26601635 0.77 — —
SCHEMBL26607129 0.75 — —
SCHEMBL30624653 0.74 NPY5R (0.32) —

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-4511117-A1 HETEROARYL COMPOUNDS FOR THE TREATMENT OF PAIN Vertex Pharmaceuticals Incorporated (US) 2025-02-26 — — EP claimed
WO-2023205465-A1 HETEROARYL COMPOUNDS FOR THE TREATMENT OF PAIN VERTEX PHARMACEUTICALS INCORPORATED (US) 2023-10-26 — — WO claimed
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