SCHEMBL12270299

SCHEMBL12270299

CCOCc1ccc(B(OCCNC)c2ccc(OCc3ccc(B(OCCNC)c4ccc(C)cc4)cc3)cc2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.40
▸ MAPT P10636 1/20 0.40
▸ MAPK1 P28482 1/20 0.40
▸ MAOB P27338 4/20 0.39
▸ LYPLA1 O75608 1/20 0.39
▸ LYPLA2 O95372 1/20 0.39
▸ PARP10 Q53GL7 1/20 0.39
▸ NPC1 O15118 3/20 0.38
▸ RAB9A P51151 3/20 0.38
▸ CASP3 P42574 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ SENP8 Q96LD8 1/20 0.38
▸ SENP7 Q9BQF6 1/20 0.38
▸ SENP6 Q9GZR1 1/20 0.38
▸ FFAR1 O14842 1/20 0.37
▸ HRH3 Q9Y5N1 1/20 0.37
▸ DRD2 P14416 1/20 0.35
▸ DRD4 P21917 1/20 0.35
▸ DRD3 P35462 1/20 0.35
▸ APP P05067 1/20 0.35

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
SCHEMBL12270536 0.85 PARP10 (0.43) ALDH1A1MAPTMAPK1MAOBLYPLA1
SCHEMBL12271043 0.84 MAOB (0.47) ALDH1A1MAPTMAPK1MAOBFFAR1
SCHEMBL12266342 0.82 LYPLA1 (0.50) LYPLA1LYPLA2L3MBTL1
SCHEMBL12270597 0.80 LYPLA1 (0.45) LYPLA1LYPLA2CARM1PRMT1
SCHEMBL12266320 0.79 LPL (0.38) ALDH1A1MAPK1LYPLA1LYPLA2DRD2
SCHEMBL16151506 0.78 MAOB (0.51) MAOBFFAR1CARM1
SCHEMBL12270469 0.77 LYPLA1 (0.42) LYPLA1LYPLA2CARM1PRMT1
SCHEMBL12270296 0.77 MAOB (0.50) ALDH1A1MAPTMAPK1MAOBPARP10
SCHEMBL12266290 0.73 CYP1A2 (0.49) ALDH1A1MAPK1LYPLA1LYPLA2DRD2
SCHEMBL2406190 0.73 SIGMAR1 (0.39) LYPLA1LYPLA2L3MBTL1

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
US-8853424-B2 Protein cross-linking inhibitor JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2014-10-07 — — US disclosed
US-20110212919-A1 PROTEIN CROSS-LINKING INHIBITOR JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2011-09-01 — — US 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-20110212919-A1 PROTEIN CROSS-LINKING INHIBITOR BAZ2B, PRMT1, BRIX1 ALDH1A1 4540/4885MAPT 3240/4885MAPK1 794/4885

“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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