SCHEMBL2720641

SCHEMBL2720641

CCOC(=O)Cc1nc(N)sc1C(=O)OCC

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 10/20 0.63
CYP1A2 P05177 1/20 0.63
HPGD P15428 4/20 0.58
HSD17B10 Q99714 3/20 0.53
SMN1; SMN2 Q16637 3/20 0.49
LMNA P02545 1/20 0.48
FBP1 P09467 1/20 0.45
MAPT P10636 5/20 0.45
NPC1 O15118 2/20 0.45
RAB9A P51151 2/20 0.45
GAA P10253 2/20 0.44
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
KDM4E B2RXH2 2/20 0.43
CDC7 O00311 1/20 0.43
DBF4 Q9UBU7 1/20 0.43
GLA P06280 1/20 0.43
CASP1 P29466 1/20 0.43
CASP7 P55210 1/20 0.43
ATM Q13315 1/20 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
SCHEMBL2082176 0.88 ALDH1A1 (0.67) ALDH1A1CYP1A2HPGDHSD17B10SMN1; SMN2
SCHEMBL13125915 0.87 ALDH1A1 (0.61) ALDH1A1CYP1A2HPGDHSD17B10SMN1; SMN2
SCHEMBL1552396 0.86 ALDH1A1 (0.69) ALDH1A1CYP1A2HPGDHSD17B10SMN1; SMN2
SCHEMBL859765 0.86 ALDH1A1 (0.69) ALDH1A1CYP1A2HPGDHSD17B10SMN1; SMN2
SCHEMBL2823884 0.85 ALDH1A1 (0.63) ALDH1A1CYP1A2HPGDHSD17B10SMN1; SMN2
SCHEMBL2719635 0.84 NPC1 (0.49) ALDH1A1CYP1A2HPGDHSD17B10SMN1; SMN2
SCHEMBL30740576 0.83 ALDH1A1 (0.47) ALDH1A1CYP1A2HPGDHSD17B10SMN1; SMN2
SCHEMBL999513 0.83 SMN1; SMN2 (0.53) ALDH1A1CYP1A2HPGDHSD17B10SMN1; SMN2
SCHEMBL15581984 0.82 ALDH1A1 (0.46) ALDH1A1CYP1A2HPGDHSD17B10SMN1; SMN2
SCHEMBL2720481 0.82 ALDH1A1 (0.46) ALDH1A1CYP1A2HPGDHSD17B10SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117229281-A Di-parallel ring derivative regulator, preparation method and application thereof 上海翰森生物医药科技有限公司 2023-12-15 CN disclosed
EP-2635587-B1 6-ARYLAMINO PYRIDONE CARBOXAMIDE AS MEK INHIBITORS CENTAURUS BIOPHARMA CO LTD (CN) 2017-02-15 EP disclosed
EP-2635587-B1 6-ARYLAMINO PYRIDONE CARBOXAMIDE AS MEK INHIBITORS CENTAURUS BIOPHARMA CO LTD (CN) 2017-02-15 EP disclosed
US-9540396-B2 6-arylamino pyridone carboxamide as MEK inhibitors CENTAURUS BIOPHARMA CO., LTD. (CN) 2017-01-10 US disclosed
US-9540396-B2 6-arylamino pyridone carboxamide as MEK inhibitors CENTAURUS BIOPHARMA CO., LTD. (CN) 2017-01-10 US disclosed
US-9540396-B2 6-arylamino pyridone carboxamide as MEK inhibitors CENTAURUS BIOPHARMA CO., LTD. (CN) 2017-01-10 US disclosed
US-20140080804-A1 NOVEL 6-ARYLAMINO PYRIDONE CARBOXAMIDE AS MEK INHIBITORS CENTAURUS BIOPHARMA CO., LTD. (CN) 2014-03-20 US disclosed
US-20140080804-A1 NOVEL 6-ARYLAMINO PYRIDONE CARBOXAMIDE AS MEK INHIBITORS CENTAURUS BIOPHARMA CO., LTD. (CN) 2014-03-20 US disclosed
US-20140080804-A1 NOVEL 6-ARYLAMINO PYRIDONE CARBOXAMIDE AS MEK INHIBITORS CENTAURUS BIOPHARMA CO., LTD. (CN) 2014-03-20 US disclosed
EP-2635587-A1 NOVEL 6-ARYLAMINO PYRIDONE CARBOXAMIDE AS MEK INHIBITORS Centaurus Biopharma Co., Ltd. (CN) 2013-09-11 EP disclosed
WO-2012059041-A1 NOVEL 6-ARYLAMINO PYRIDONE CARBOXAMIDE AS MEK INHIBITORS CENTAURUS BIOPHARMA CO., LTD. (CN) 2012-05-10 WO disclosed
WO-2012059041-A1 NOVEL 6-ARYLAMINO PYRIDONE CARBOXAMIDE AS MEK INHIBITORS CENTAURUS BIOPHARMA CO., LTD. (CN) 2012-05-10 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-20140080804-A1 NOVEL 6-ARYLAMINO PYRIDONE CARBOXAMIDE AS MEK INHIBITORS MAP3K6, MAP3K1, MAP3K21 ALDH1A1 3046/4885CYP1A2 907/4885HPGD 1125/4885

“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.