SCHEMBL4597201

SCHEMBL4597201

CCOC(=O)c1cnc(Nc2ccc(NC(=O)OC(C)(C)C)cc2)nc1C

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 4/20 0.69
▸ NPC1 O15118 2/20 0.69
▸ RAB9A P51151 3/20 0.52
▸ NPSR1 Q6W5P4 1/20 0.52
▸ ALDH1A1 P00352 1/20 0.51
▸ PKM P14618 1/20 0.51
▸ SMN1; SMN2 Q16637 1/20 0.51
▸ SYK P43405 4/20 0.45
▸ CYP1A2 P05177 1/20 0.44
▸ CYP3A4 P08684 1/20 0.44
▸ CYP2C8 P10632 1/20 0.44
▸ CYP2C9 P11712 1/20 0.44
▸ NPR3 P17342 1/20 0.44
▸ CYP2C19 P33261 1/20 0.44
▸ BRD4 O60885 1/20 0.44
▸ SIRT5 Q9NXA8 2/20 0.43
▸ MAPKAPK2 P49137 1/20 0.43
▸ LMNA P02545 1/20 0.43
▸ MEN1 O00255 2/20 0.43
▸ KMT2A Q03164 2/20 0.43

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
SCHEMBL27726351 0.86 NPC1 (0.49) MAPTNPC1SMN1; SMN2SYKNPR3
SCHEMBL4595936 0.82 MAPT (0.78) MAPTNPC1RAB9ANPSR1ALDH1A1
SCHEMBL12942871 0.81 SYK (0.56) MAPTNPC1SYKBRD4
SCHEMBL12942870 0.81 SYK (0.64) MAPTNPC1RAB9ANPSR1ALDH1A1
SCHEMBL4597884 0.81 SYK (0.47) MAPTNPC1SYKCYP1A2CYP3A4
SCHEMBL18012019 0.80 SYK (0.60) MAPTSYKBRD4SIRT5LMNA
SCHEMBL655363 0.80 MAPT (0.61) MAPTNPC1RAB9ANPSR1ALDH1A1
SCHEMBL5593053 0.76 ALDH1A1 (0.47) MAPTNPC1NPSR1ALDH1A1SYK
SCHEMBL4921029 0.75 MAPT (0.61) MAPTNPC1RAB9ANPSR1ALDH1A1
SCHEMBL15752433 0.75 SYK (0.60) SYKBRD4SIRT5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1924265-A2 CHEMOKINE RECEPTOR BINDING COMPOUNDS Genzyme Corporation (US) 2008-05-28 — — EP disclosed
US-20070066624-A1 Chemokine receptor binding compounds ANORMED, INC. (CA) 2007-03-22 — — US disclosed
WO-2007022371-A2 CHEMOKINE RECEPTOR BINDING COMPOUNDS GENZYME CORPORATION (US) 2007-02-22 — — WO 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-20070066624-A1 Chemokine receptor binding compounds CCR5, CCR4, CCR1 MAPT 3432/4885NPC1 473/4885RAB9A 2707/4885

“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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