SCHEMBL12783279

SCHEMBL12783279

CNC(=O)NCCOC(C)C

nearest known ligand 0.53

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 2/20 0.53
ALDH1A1 P00352 3/20 0.44
TSHR P16473 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
KMT2A Q03164 2/20 0.38
MEN1 O00255 1/20 0.38
KEAP1 Q14145 1/20 0.37
NFE2L2 Q16236 1/20 0.37
SMN1; SMN2 Q16637 2/20 0.36
LMNA P02545 2/20 0.36
HTT P42858 1/20 0.36
GAA P10253 1/20 0.36
NAMPT P43490 1/20 0.35
MAPK1 P28482 1/20 0.35

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
SCHEMBL13853552 0.88 ALDH1A1 (0.59) EPHX2ALDH1A1TSHRL3MBTL1KMT2A
SCHEMBL19821963 0.82 EPHX2 (0.39) EPHX2TSHRKMT2AMEN1KEAP1
SCHEMBL12783274 0.82 EPHX2 (0.51) EPHX2ALDH1A1TSHRL3MBTL1KMT2A
SCHEMBL24850621 0.82 ALDH1A1 (0.56) EPHX2ALDH1A1TSHRL3MBTL1KMT2A
SCHEMBL3555994 0.78 EPHX2 (0.47) EPHX2ALDH1A1TSHRL3MBTL1KMT2A
SCHEMBL5981227 0.78 EPHX2 (0.47) EPHX2ALDH1A1TSHRL3MBTL1KMT2A
SCHEMBL19171879 0.78 KMT2A (0.48) EPHX2KMT2AMEN1KEAP1NFE2L2
SCHEMBL7900023 0.77 EPHX2 (0.46) EPHX2ALDH1A1TSHRL3MBTL1KMT2A
SCHEMBL13681684 0.77 EPHX2 (0.46) EPHX2ALDH1A1TSHRL3MBTL1KMT2A
SCHEMBL24595703 0.77 EPHX2 (0.46) EPHX2ALDH1A1TSHRL3MBTL1KMT2A

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 5 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-7897601-B2 Cannabinoid receptor modulators INTERVET, INC. (US) 2011-03-01 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
US-20070197628-A1 Cannabinoid receptor modulators INTERVET INTERNATIONAL B.V. (NL) 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 (3 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 EPHX2 2164/4885ALDH1A1 165/4885TSHR 210/4885
US-20090131424-A1 THIAZOLYL-DIHYDRO-CHINAZOLINE CYP3A7, UGT2B7, UGT1A7 EPHX2 2164/4885ALDH1A1 165/4885TSHR 210/4885
US-20070197628-A1 Cannabinoid receptor modulators CNR1, CNR2, GPR18 EPHX2 2025/4885ALDH1A1 1999/4885TSHR 681/4885

“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.