SCHEMBL12376662

SCHEMBL12376662

CC(C)(C)NC(=O)c1nccn(-c2ccc(F)cc2)c1=O

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GRM1 Q13255 1/20 0.41
TP53 P04637 3/20 0.41
THRB P10828 2/20 0.41
MET P08581 1/20 0.41
AXL P30530 1/20 0.41
TYRO3 Q06418 1/20 0.41
MERTK Q12866 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.40
MAPT P10636 3/20 0.39
ANO1 Q5XXA6 1/20 0.39
NR3C2 P08235 1/20 0.39
LMNA P02545 3/20 0.38
RXFP1 Q9HBX9 1/20 0.38
DGAT2 Q96PD7 1/20 0.38
GAA P10253 1/20 0.38
RIPK1 Q13546 1/20 0.38
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38
POLB P06746 1/20 0.38

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
SCHEMBL13101595 0.88 RIPK1 (0.41) GRM1TP53THRBMAPTANO1
SCHEMBL12376648 0.87 RIPK1 (0.50) TP53SMN1; SMN2RIPK1ALDH1A1POLB
SCHEMBL12409686 0.81 MET (0.40) GRM1TP53THRBMETAXL
SCHEMBL30716516 0.80 KDM4E (0.54) GRM1TP53THRBMETAXL
SCHEMBL2287453 0.79 KMT2A (0.50) GRM1TP53THRBSMN1; SMN2MAPT
SCHEMBL27761998 0.78 LMNA (0.40) GRM1TP53THRBMETAXL
SCHEMBL12376654 0.76 MET (0.50) METAXLTYRO3MERTKRIPK1
SCHEMBL13368441 0.76 POLB (0.55) METAXLTYRO3MERTKGAA
SCHEMBL13101593 0.75 ALDH1A1 (0.39) TP53THRBSMN1; SMN2MAPTRIPK1
SCHEMBL12561354 0.73 MET (0.55) METAXLTYRO3MERTKRIPK1

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-8003662-B2 Heterobicyclic thiophene compounds and methods of use ARRAY BIOPHARMA, INC. (US) 2011-08-23 US disclosed
US-20070197537-A1 Heterobicyclic thiophene compounds and methods of use ARRAY BIOPHARMA, INC. 2007-08-23 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-20070197537-A1 Heterobicyclic thiophene compounds and methods of use ERBB2, LCK, SRC GRM1 1101/4885TP53 403/4885THRB 125/4885

“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.