SCHEMBL11027058

SCHEMBL11027058

CCOC(=O)c1ccc2c(c1)C(C)(C)CC(c1cncc(N3CCN(c4ccc(C)cc4C)CC3)c1)N2

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 1/20 0.46
▸ TP53 P04637 6/20 0.43
▸ LMNA P02545 3/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ THRB P10828 1/20 0.38
▸ RARA P10276 2/20 0.37
▸ RARB P10826 2/20 0.37
▸ ALDH1A1 P00352 1/20 0.37
▸ DPP4 P27487 1/20 0.36
▸ DPP8 Q6V1X1 1/20 0.36
▸ DPP9 Q86TI2 1/20 0.36
▸ DPP7 Q9UHL4 1/20 0.36
▸ PRMT1 Q99873 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
SCHEMBL11025741 0.90 POLB (0.38) MAPTTP53LMNASMN1; SMN2ALDH1A1
SCHEMBL11029232 0.89 MAPT (0.47) MAPTTP53LMNASMN1; SMN2THRB
SCHEMBL11027123 0.89 MAPT (0.36) MAPTTP53LMNAALDH1A1
SCHEMBL11028354 0.86 SIRT2 (0.45) MAPTTP53LMNASMN1; SMN2THRB
SCHEMBL11024311 0.85 MMP2 (0.38) MAPTTP53LMNA
SCHEMBL11940902 0.83 SCN9A (0.40) MAPTTP53
SCHEMBL11025456 0.79 SMN1; SMN2 (0.42) MAPTTP53SMN1; SMN2THRBRARA
SCHEMBL11022770 0.78 POLB (0.41) MAPTTP53SMN1; SMN2ALDH1A1
SCHEMBL11027119 0.75 MAPT (0.33) MAPTTP53LMNASMN1; SMN2ALDH1A1
SCHEMBL11025475 0.74 KMO (0.40) MAPTRARARARBALDH1A1

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-8809369-B2 Tetrahydroquinoline derivatives HOFFMANN-LA ROCHE INC. (US) 2014-08-19 — — US disclosed
EP-2668165-A1 NOVEL TETRAHYDROQUINOLINE DERIVATIVES F.HOFFMANN-LA ROCHE AG (CH) 2013-12-04 — — EP disclosed
WO-2012101068-A1 NOVEL TETRAHYDROQUINOLINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2012-08-02 — — WO disclosed
US-20120190677-A1 NOVEL TETRAHYDROQUINOLINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2012-07-26 — — 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-20120190677-A1 NOVEL TETRAHYDROQUINOLINE DERIVATIVES RAB1A, RABL3, RAB7A MAPT 3428/4885TP53 2718/4885LMNA 3043/4885

“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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