SCHEMBL25244382

SCHEMBL25244382

NCc1ccncc1C[C]=O

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ LOXL2 Q9Y4K0 2/20 0.55
▸ AOC1 P19801 11/20 0.52
▸ AOC3 Q16853 11/20 0.52
▸ CYP2E1 P05181 5/20 0.44
▸ CYP2C8 P10632 5/20 0.44
▸ CYP2D6 P10635 5/20 0.44
▸ CYP2A6 P11509 5/20 0.44
▸ CYP2B6 P20813 5/20 0.44
▸ CYP2C19 P33261 5/20 0.44
▸ CYP2C9 P11712 4/20 0.38
▸ CYP1A2 P05177 3/20 0.36
▸ CYP3A4 P08684 2/20 0.36

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
SCHEMBL11779159 0.81 AOC1 (0.67) LOXL2AOC1AOC3CYP2E1CYP2C8
SCHEMBL21919812 0.78 AOC1 (0.57) LOXL2AOC1AOC3CYP2E1CYP2C8
SCHEMBL3069406 0.74 AOC1 (0.57) LOXL2AOC1AOC3CYP2E1CYP2C8
SCHEMBL2642640 0.74 AOC1 (0.57) LOXL2AOC1AOC3CYP2E1CYP2C8
SCHEMBL16547436 0.74 AOC1 (0.57) LOXL2AOC1AOC3CYP2E1CYP2C8
SCHEMBL6875423 0.73 DPP4 (0.46) LOXL2CYP2A6
SCHEMBL22326462 0.71 — —
SCHEMBL3290073 0.71 — —
Pyridine SCHEMBL21379301 0.70 LOXL2 (0.52) LOXL2AOC1AOC3CYP2A6
SCHEMBL11614582 0.69 AOC1 (0.52) LOXL2AOC1AOC3CYP2E1CYP2C8

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118354781-A Peptide inhibitors of interleukin-23 receptor 西兰制药公司 2024-07-16 — — CN claimed
WO-2023099669-A1 PEPTIDE INHIBITORS OF INTERLEUKIN-23 RECEPTOR ZEALAND PHARMA A/S (DK) 2023-06-08 — — WO claimed
CN-118354781-A Peptide inhibitors of interleukin-23 receptor 西兰制药公司 2024-07-16 — — CN disclosed
WO-2023099669-A1 PEPTIDE INHIBITORS OF INTERLEUKIN-23 RECEPTOR ZEALAND PHARMA A/S (DK) 2023-06-08 — — WO disclosed
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