SCHEMBL13853837

SCHEMBL13853837

CNC(=O)NCc1cccc(C(=O)N(C)C(C)C)c1

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 1/20 0.46
▸ ROCK2 O75116 4/20 0.42
▸ MEP1B Q16820 4/20 0.41
▸ SLC7A5 Q01650 1/20 0.41
▸ KMT2A Q03164 2/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ NAMPT P43490 1/20 0.40
▸ ROCK1 Q13464 1/20 0.40
▸ FBP1 P09467 1/20 0.40
▸ NR1H4 Q96RI1 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.39
▸ MMP13 P45452 1/20 0.39

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
SCHEMBL13853839 0.86 NAMPT (0.47) PPARGROCK2SLC7A5KMT2AMEN1
SCHEMBL13853833 0.85 MEN1 (0.45) PPARGROCK2MEP1BSLC7A5KMT2A
SCHEMBL13853877 0.80 MAPT (0.47) ROCK2KMT2AMEN1ROCK1
SCHEMBL13853838 0.79 SLC7A5 (0.55) PPARGROCK2SLC7A5KMT2AROCK1
SCHEMBL1692133 0.79 KMT2A (0.47) PPARGSLC7A5KMT2AMEN1
SCHEMBL13853836 0.78 ROCK2 (0.61) ROCK2SLC7A5KMT2ANAMPTROCK1
SCHEMBL13853740 0.77 F10 (0.54) ROCK2MEP1BROCK1NR1H4
SCHEMBL13853832 0.77 KMT2A (0.66) PPARGROCK2KMT2AMEN1NAMPT
SCHEMBL24721325 0.76 KMT2A (0.45) PPARGSLC7A5KMT2AMEN1
SCHEMBL14072399 0.76 KAT6A (0.47) PPARGKMT2AMEN1

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-8354418-B2 Thiazolyl-dihydro-quinazolines BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2013-01-15 — — US disclosed
US-20090131424-A1 THIAZOLYL-DIHYDRO-CHINAZOLINE BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2009-05-21 — — US disclosed
US-20070238746-A1 THIAZOLYL-DIHYDRO-CHINAZOLINE BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2007-10-11 — — 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 (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-20070238746-A1 THIAZOLYL-DIHYDRO-CHINAZOLINE CYP3A7, UGT2B7, UGT1A7 PPARG 688/4885ROCK2 1291/4885MEP1B 4043/4885
US-20090131424-A1 THIAZOLYL-DIHYDRO-CHINAZOLINE CYP3A7, UGT2B7, UGT1A7 PPARG 688/4885ROCK2 1291/4885MEP1B 4043/4885

“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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