SCHEMBL30323627

SCHEMBL30323627

CCN(CC)C(=O)c1coc2cc(NC(=O)OC(C)(C)C)ccc12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA12 O43570 1/20 0.50
▸ CA1 P00915 1/20 0.50
▸ CA9 Q16790 1/20 0.50
▸ NR1I3 Q14994 3/20 0.39
▸ NPC1 O15118 3/20 0.38
▸ RAB9A P51151 3/20 0.38
▸ KDM4E B2RXH2 2/20 0.38
▸ ALDH1A1 P00352 2/20 0.38
▸ HPGD P15428 2/20 0.38
▸ SMN1; SMN2 Q16637 2/20 0.38
▸ HSD17B10 Q99714 1/20 0.38
▸ NAMPT P43490 2/20 0.38
▸ CYP17A1 P05093 2/20 0.38
▸ MAPT P10636 1/20 0.37
▸ JAK2 O60674 1/20 0.36
▸ NQO2 P16083 1/20 0.36
▸ ACHE P22303 1/20 0.36
▸ BACE1 P56817 1/20 0.36
▸ HSP90AA1 P07900 1/20 0.36
▸ HSP90AB1 P08238 1/20 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
SCHEMBL28632960 1.00 CA12 (0.50) CA12CA1CA9NR1I3NPC1
SCHEMBL23320570 0.83 NAMPT (0.41) NPC1RAB9AKDM4EALDH1A1HPGD
SCHEMBL10013756 0.78 ALDH1A1 (0.43) CA12CA1CA9NR1I3NPC1
SCHEMBL16513027 0.76 CA12 (0.42) CA12CA1CA9NR1I3NPC1
SCHEMBL8656856 0.75 CA12 (0.52) CA12CA1CA9RAB9AKDM4E
SCHEMBL24950219 0.75 CA12 (0.52) CA12CA1CA9NPC1RAB9A
SCHEMBL30943290 0.74 NAMPT (0.69) RAB9AALDH1A1NAMPT
SCHEMBL23320429 0.74 NAMPT (0.69) RAB9AALDH1A1NAMPT
SCHEMBL30943194 0.73 USP2 (0.53) NPC1RAB9AALDH1A1HPGDSMN1; SMN2
SCHEMBL23320347 0.72 NAMPT (0.57) KDM4ESMN1; SMN2NAMPT

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
US-12263159-B2 Fused ring compound having urea structure Sanford Burnham Prebys Medical Discovery Institute (US) 2025-04-01 — — US disclosed
US-20240285597-A1 FUSED RING COMPOUND HAVING UREA STRUCTURE DAIICHI SANKYO COMPANY LIMITED (JP) 2024-08-29 — — US disclosed
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
EP-3818053-B1 FUSED RING COMPOUND HAVING UREA STRUCTURE SANFORD BURNHAM PREBYS MEDICAL DISCOVERY INST (US) 2023-03-29 — — EP 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 (2 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-12263159-B2 Fused ring compound having urea structure NAMPT, NME4, NDUFAB1 CA12 4727/4885CA1 4730/4885CA9 4237/4885
US-20240285597-A1 FUSED RING COMPOUND HAVING UREA STRUCTURE NAMPT, NME4, NDUFAB1 CA12 4727/4885CA1 4730/4885CA9 4237/4885

“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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