SCHEMBL24042535

SCHEMBL24042535

O=C(NCc1cnco1)Nc1ccc2nc(-c3ccccc3)oc2c1

nearest known ligand 0.70

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ NAMPT P43490 17/20 0.70
▸ CASP3 P42574 1/20 0.58
▸ SENP8 Q96LD8 1/20 0.58
▸ SENP7 Q9BQF6 1/20 0.58
▸ SENP6 Q9GZR1 1/20 0.58
▸ NPC1 O15118 2/20 0.55
▸ RAB9A P51151 2/20 0.55
▸ MAPT P10636 1/20 0.55
▸ SMN1; SMN2 Q16637 1/20 0.55
▸ NPSR1 Q6W5P4 1/20 0.55
▸ HSD17B10 Q99714 1/20 0.55
▸ MEN1 O00255 1/20 0.49
▸ KMT2A Q03164 1/20 0.49

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
SCHEMBL23320381 0.82 NAMPT (1.00) NAMPTCASP3SENP8SENP7SENP6
SCHEMBL23432009 0.78 NAMPT (0.77) NAMPT
SCHEMBL23320402 0.77 NAMPT (0.81) NAMPTCASP3SENP8SENP7SENP6
SCHEMBL29802090 0.75 CASP3 (0.70) NAMPTCASP3SENP8SENP7SENP6
SCHEMBL29802067 0.75 CASP3 (0.70) NAMPTCASP3SENP8SENP7SENP6
SCHEMBL26932345 0.75 CASP3 (0.70) NAMPTCASP3SENP8SENP7SENP6
SCHEMBL26932297 0.75 CASP3 (0.70) NAMPTCASP3SENP8SENP7SENP6
SCHEMBL26932280 0.75 CASP3 (0.73) NAMPTCASP3SENP8SENP7SENP6
SCHEMBL29802221 0.75 CASP3 (0.73) NAMPTCASP3SENP8SENP7SENP6
SCHEMBL23320408 0.74 NAMPT (0.84) NAMPTNPC1RAB9AMAPTSMN1; SMN2

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-112654608-A Condensed ring compounds having urea structure 桑福德伯纳姆普利斯医学发现研究所 2021-04-13 — — CN claimed
CN-112654608-B Fused ring compound having urea structure 桑福德伯纳姆普利斯医学发现研究所 2024-05-07 — — CN disclosed
US-20210361636-A1 FUSED RING COMPOUND HAVING UREA STRUCTURE DAIICHI SANKYO COMPANY LIMITED (JP) 2021-11-25 — — US disclosed
CN-112654608-A Condensed ring compounds having urea structure 桑福德伯纳姆普利斯医学发现研究所 2021-04-13 — — CN disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20210361636-A1 FUSED RING COMPOUND HAVING UREA STRUCTURE NAMPT, NME4, ABAT NAMPT 1/4885CASP3 1899/4885SENP8 2575/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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