SCHEMBL2136580

SCHEMBL2136580

CCOC(=O)c1ccc2c(c1)C(C)(C)CC(c1ccccc1NS(=O)(=O)c1ccccc1)N2

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 5/20 0.48
▸ TSHR P16473 2/20 0.48
▸ MCL1 Q07820 1/20 0.44
▸ LMNA P02545 7/20 0.43
▸ ALDH1A1 P00352 6/20 0.43
▸ KDM4E B2RXH2 4/20 0.43
▸ MAPT P10636 2/20 0.41
▸ SMN1; SMN2 Q16637 6/20 0.40
▸ HTT P42858 3/20 0.40
▸ HPGD P15428 3/20 0.40
▸ NPC1 O15118 2/20 0.40
▸ GAA P10253 1/20 0.40
▸ TDP1 Q9NUW8 1/20 0.40
▸ TP53 P04637 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ NPSR1 Q6W5P4 1/20 0.40
▸ MEN1 O00255 4/20 0.39
▸ FNTA P49354 1/20 0.39
▸ FNTB P49356 1/20 0.39
▸ AR P10275 1/20 0.39

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
SCHEMBL2135975 0.93 LMNA (0.41) KMT2ATSHRMCL1LMNAALDH1A1
SCHEMBL2135798 0.92 NPSR1 (0.42) KMT2ATSHRMCL1LMNAALDH1A1
SCHEMBL2140482 0.91 HIF1A (0.41) KMT2ATSHRMCL1LMNAALDH1A1
SCHEMBL2141345 0.90 HPGD (0.42) KMT2ATSHRMCL1ALDH1A1KDM4E
SCHEMBL2140344 0.88 TSHR (0.51) KMT2ATSHRLMNAALDH1A1KDM4E
SCHEMBL2136642 0.88 PRKAB2 (0.41) KMT2ATSHRMCL1LMNAALDH1A1
SCHEMBL2135133 0.83 METAP2 (0.42) TSHRMCL1LMNAALDH1A1MAPT
SCHEMBL2135937 0.82 SLC16A3 (0.44) KMT2AMCL1ALDH1A1KDM4EMAPT
SCHEMBL16239528 0.82 ACHE (0.41) MCL1GAACYP2C9CYP1A2
SCHEMBL2137378 0.81 LMNA (0.51) KMT2ATSHRLMNAALDH1A1KDM4E

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-2630124-B1 TETRAHYDROQUINOLINE DERIVATIVES USED AS AMPK ACTIVATORS HOFFMANN LA ROCHE (CH) 2014-11-19 — — EP disclosed
US-8546427-B2 Tetrahydroquinoline derivatives HOFFMANN-LA ROCHE INC. (US) 2013-10-01 — — US disclosed
US-20120101127-A1 NOVEL TETRAHYDROQUINOLINE DERIVATIVES HUA MEDICINE (KY) 2012-04-26 — — 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-20120101127-A1 NOVEL TETRAHYDROQUINOLINE DERIVATIVES PRKAG1, PRKAB1, PRKAG2 KMT2A 1455/4885TSHR 1744/4885MCL1 1280/4885

“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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