SCHEMBL11024877

SCHEMBL11024877

CCOC(=O)c1ccc2c(c1)C(C)(C)CC(c1cncc(-c3ccc(C(C)(C)C)cc3)c1)N2

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CASR P41180 1/20 0.37
▸ LMNA P02545 1/20 0.36
▸ KDM4E B2RXH2 2/20 0.34
▸ ALDH1A1 P00352 2/20 0.34
▸ MAPT P10636 4/20 0.34
▸ MEN1 O00255 4/20 0.34
▸ KMT2A Q03164 4/20 0.34
▸ NPC1 O15118 1/20 0.34
▸ GAA P10253 1/20 0.34
▸ CYP2C9 P11712 1/20 0.34
▸ CYP2C19 P33261 1/20 0.34
▸ RAB9A P51151 1/20 0.34
▸ RARA P10276 3/20 0.34
▸ RARB P10826 3/20 0.34
▸ AKR1B1 P15121 1/20 0.34
▸ RARG P13631 1/20 0.34
▸ AR P10275 1/20 0.33
▸ F10 P00742 1/20 0.33
▸ F11 P03951 1/20 0.33
▸ F7 P08709 1/20 0.33

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
SCHEMBL11025597 0.88 F11 (0.42) CASRARF10F11F7
SCHEMBL11025182 0.88 F11 (0.40) RARARARBRARGF10F11
SCHEMBL11028154 0.87 MKNK1 (0.42) F10F11F7
SCHEMBL11025456 0.83 SMN1; SMN2 (0.42) KDM4EALDH1A1MAPTMEN1KMT2A
SCHEMBL11024143 0.82 MAP4K4 (0.35) F10F11F7
SCHEMBL11940913 0.80 SCN9A (0.37) F10F11F7
SCHEMBL2534217 0.80 LMNA (0.38) CASRLMNAKDM4EALDH1A1MAPT
SCHEMBL11028354 0.77 SIRT2 (0.45) LMNAKDM4EALDH1A1MAPTMEN1
SCHEMBL11027270 0.76 CACNA1F (0.46) LMNAALDH1A1MAPTKMT2ACYP2C9
SCHEMBL11023687 0.75 F11 (0.50) RARARARBRARGF10F11

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-8809369-B2 Tetrahydroquinoline derivatives HOFFMANN-LA ROCHE INC. (US) 2014-08-19 — — US 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 CASR 3521/4885LMNA 3043/4885KDM4E 1324/4885

“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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