SCHEMBL2140482

SCHEMBL2140482

CCOC(=O)c1ccc2c(c1)C(C)(C)CC(c1ccccc1NS(=O)(=O)c1cccnc1)N2

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HIF1A Q16665 1/20 0.41
▸ TSHR P16473 3/20 0.39
▸ KMT2A Q03164 3/20 0.39
▸ ALDH1A1 P00352 4/20 0.38
▸ KDM4E B2RXH2 3/20 0.38
▸ MEN1 O00255 2/20 0.37
▸ SMN1; SMN2 Q16637 2/20 0.37
▸ CYP1A2 P05177 1/20 0.37
▸ CYP3A4 P08684 1/20 0.37
▸ CYP2D6 P10635 1/20 0.37
▸ CYP2C9 P11712 1/20 0.37
▸ CYP2C19 P33261 1/20 0.37
▸ TP53 P04637 1/20 0.36
▸ NPSR1 Q6W5P4 1/20 0.36
▸ MCL1 Q07820 1/20 0.36
▸ MAPT P10636 1/20 0.36
▸ LMNA P02545 2/20 0.36
▸ SLC40A1 Q9NP59 3/20 0.36
▸ JAK2 O60674 1/20 0.36
▸ JAK1 P23458 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
SCHEMBL2136580 0.91 KMT2A (0.48) TSHRKMT2AALDH1A1KDM4EMEN1
SCHEMBL2138836 0.89 TBXA2R (0.41) TSHRKMT2AALDH1A1KDM4ESLC40A1
SCHEMBL2135798 0.87 NPSR1 (0.42) TSHRKMT2AALDH1A1KDM4EMEN1
SCHEMBL2135975 0.87 LMNA (0.41) TSHRKMT2AALDH1A1KDM4EMEN1
SCHEMBL2141345 0.85 HPGD (0.42) TSHRKMT2AALDH1A1KDM4EMEN1
SCHEMBL16239546 0.83 USP2 (0.40) SLC40A1GLO1
SCHEMBL2140344 0.83 TSHR (0.51) TSHRKMT2AALDH1A1KDM4ETP53
SCHEMBL2138380 0.83 SLC40A1 (0.40) SLC40A1JAK2JAK1TYK2JAK3
SCHEMBL2133536 0.82 KMT2A (0.46) TSHRKMT2ACYP3A4SLC40A1NAMPT
SCHEMBL2615622 0.81 SLC40A1 (0.39) KMT2ASLC40A1JAK2JAK1TYK2

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 HIF1A 726/4885TSHR 1744/4885KMT2A 1455/4885

“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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