SCHEMBL10264658

SCHEMBL10264658

CCc1cnn(CC(=O)C(C)(C)C)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.43
NPC1 O15118 3/20 0.41
ALDH1A1 P00352 3/20 0.41
MITF O75030 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
RAB9A P51151 2/20 0.41
MAPT P10636 2/20 0.41
HTT P42858 1/20 0.41
GRIN2B Q13224 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.36
GAA P10253 1/20 0.35
POLB P06746 1/20 0.35
KMT2A Q03164 2/20 0.35
MEN1 O00255 1/20 0.34
HPGD P15428 1/20 0.34
TP53 P04637 1/20 0.33
MAPK1 P28482 1/20 0.33
ALPI P09923 1/20 0.33
ALPG P10696 1/20 0.33
PLAA Q9Y263 1/20 0.33

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
SCHEMBL10264110 0.81 L3MBTL1 (0.42) TSHRALDH1A1SMN1; SMN2MAPTHTT
SCHEMBL26714461 0.81 L3MBTL1 (0.39) TSHRNPC1ALDH1A1MITFSMN1; SMN2
SCHEMBL19020680 0.79 ERCC5 (0.42) TSHRMAPTL3MBTL1GAATP53
SCHEMBL12020135 0.78 CCNC (0.42) TSHRMAPTL3MBTL1GAATP53
SCHEMBL10203238 0.78 TSHR (0.44) TSHRNPC1ALDH1A1MITFSMN1; SMN2
SCHEMBL12020134 0.77 CCNC (0.44) GRIN2BL3MBTL1
SCHEMBL12504043 0.77 GAA (0.43) TSHRNPC1ALDH1A1SMN1; SMN2MAPT
SCHEMBL12693764 0.75 PDK2 (0.39) TSHRSMN1; SMN2MAPTL3MBTL1GAA
SCHEMBL23197952 0.75 L3MBTL1 (0.35) TSHRALDH1A1MAPTHTTL3MBTL1
SCHEMBL18623452 0.75 GSK3A (0.44) ALDH1A1MITFSMN1; SMN2MAPK1

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
US-8207186-B2 Benzocycloheptapyridines as inhibitors of the receptor tyrosine kinase MET MERCK SHARP & DOHME CORP. (US) 2012-06-26 US disclosed
US-20090197908-A1 Benzocycloheptapyridines as inhibitors of the receptor tyrosine kinase met MERCK SHARP & DOHME LLC 2009-08-06 US disclosed
US-7550478-B2 Tyrosine kinase inhibitors MERCK & CO. INC. (US) 2009-06-23 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-20090197908-A1 Benzocycloheptapyridines as inhibitors of the receptor tyrosine kinase met MET, RET, ERBB2 TSHR 1321/4885NPC1 1512/4885ALDH1A1 632/4885

“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.