SCHEMBL15577159

SCHEMBL15577159

CCOC(=O)c1cnn(-c2ccc(OC(F)(F)F)cc2)n1

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.48
SLC5A1 P13866 1/20 0.46
SLC5A2 P31639 1/20 0.46
POLB P06746 2/20 0.45
TP53 P04637 2/20 0.45
L3MBTL1 Q9Y468 2/20 0.43
ELANE P08246 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.42
TEAD1 P28347 1/20 0.41
TEAD4 Q15561 1/20 0.41
TEAD2 Q15562 1/20 0.41
TEAD3 Q99594 1/20 0.41
CNR1 P21554 1/20 0.40
CNR2 P34972 1/20 0.40

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
SCHEMBL29873645 0.95 MAPT (0.45) MAPTSLC5A1SLC5A2POLBTP53
SCHEMBL23354720 0.86 MLYCD (0.47) MAPTPOLBL3MBTL1SMN1; SMN2
SCHEMBL23354751 0.86 PDE4D (0.54) MAPTPOLBTP53SMN1; SMN2
SCHEMBL23354760 0.84 GABRA2 (0.54) MAPTSLC5A1SLC5A2POLBTP53
SCHEMBL11381170 0.84 ALDH1A1 (0.52) MAPTPOLBL3MBTL1SMN1; SMN2
SCHEMBL15577193 0.83 TP53 (0.46) MAPTTP53L3MBTL1SMN1; SMN2CNR1
SCHEMBL23367410 0.83 CA12 (0.49) MAPTSMN1; SMN2
SCHEMBL18893766 0.82 DUSP3 (0.46) MAPTSLC5A1SLC5A2SMN1; SMN2
SCHEMBL18910060 0.82 CYP1A2 (0.43) SMN1; SMN2
SCHEMBL23354755 0.82 GABRA2 (0.54) MAPTPOLBSMN1; 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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230027985-A1 SUBSTITUTED HYDANTOINAMIDES AS ADAMTS7 ANTAGONISTS BAYER AKTIENGESELLSCHAFT (DE) 2023-01-26 US disclosed
US-20230027985-A1 SUBSTITUTED HYDANTOINAMIDES AS ADAMTS7 ANTAGONISTS BAYER AKTIENGESELLSCHAFT (DE) 2023-01-26 US disclosed
WO-2021094434-A1 SUBSTITUTED HYDANTOINAMIDES AS ADAMTS7 ANTAGONISTS BAYER AKTIENGESELLSCHAFT (DE) 2021-05-20 WO disclosed
WO-2021094434-A1 SUBSTITUTED HYDANTOINAMIDES AS ADAMTS7 ANTAGONISTS BAYER AKTIENGESELLSCHAFT (DE) 2021-05-20 WO disclosed
EP-3822265-A1 SUBSTITUTED HYDANTOINAMIDES AS ADAMTS7 ANTAGONISTS Bayer AG (DE) 2021-05-19 EP disclosed
EP-3822265-A1 SUBSTITUTED HYDANTOINAMIDES AS ADAMTS7 ANTAGONISTS Bayer AG (DE) 2021-05-19 EP disclosed
EP-2895478-B1 TRIAZOLE CARBOXAMIDE DERIVATIVES HOFFMANN LA ROCHE (CH) 2016-10-19 EP disclosed
US-9416127-B2 Triazole carboxamides and uses thereof HOFFMANN-LA ROCHE INC. (US) 2016-08-16 US disclosed
EP-2895478-A1 TRIAZOLE CARBOXAMIDE DERIVATIVES F. Hoffmann-La Roche AG (CH) 2015-07-22 EP disclosed
US-20150191458-A1 TRIAZOLE CARBOXAMIDES AND USES THEREOF HOFFMANN-LA ROCHE INC. (US) 2015-07-09 US disclosed
WO-2014041106-A1 TRIAZOLE CARBOXAMIDE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2014-03-20 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 (2 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-20150191458-A1 TRIAZOLE CARBOXAMIDES AND USES THEREOF TAAR1, HCRTR1, TAAR5 MAPT 545/4885SLC5A1 712/4885SLC5A2 669/4885
US-20230027985-A1 SUBSTITUTED HYDANTOINAMIDES AS ADAMTS7 ANTAGONISTS ADAMTS7, MMP7, ADAMTS1 MAPT 4378/4885SLC5A1 3482/4885SLC5A2 3697/4885

“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.