SCHEMBL6313251

SCHEMBL6313251

O=C(O)CCC(=O)Nc1c[c]ccc1Cl

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.49
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
POLB P06746 4/20 0.43
TDP1 Q9NUW8 1/20 0.43
MAPK1 P28482 1/20 0.43
ALDH1A1 P00352 1/20 0.43
CYP1A1 P04798 1/20 0.42
SHMT2 P34897 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
HTT P42858 1/20 0.42
BCHE P06276 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
CYP2C19 P33261 1/20 0.41

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
SCHEMBL6313462 0.78 CYP2C19 (0.45) KDM4EPOLBTDP1ALDH1A1CYP1A1
SCHEMBL1608851 0.78 POLB (0.72) KDM4EMEN1KMT2APOLBMAPK1
SCHEMBL13901436 0.77 KMT2A (0.74) KDM4EMEN1KMT2APOLBMAPK1
SCHEMBL2894903 0.75 ALDH1A1 (0.46) KDM4EMEN1KMT2APOLBALDH1A1
SCHEMBL7813549 0.74 GAA (0.60) MEN1KMT2APOLBTDP1MAPK1
SCHEMBL3337034 0.73 CYP1A1 (0.65) KDM4EMEN1KMT2APOLBALDH1A1
SCHEMBL7820667 0.71 CA12 (0.53) KDM4EMEN1KMT2APOLBTDP1
SCHEMBL3333827 0.71 L3MBTL1 (0.60) MEN1KMT2APOLBALDH1A1CYP1A1
SCHEMBL7824542 0.71 MEN1 (0.72) KDM4EMEN1KMT2APOLBTDP1
SCHEMBL2897809 0.71 MEN1 (0.48) KDM4EMEN1KMT2ATDP1ALDH1A1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050014810-A1 Use of substituted 2 phenylbenzimidazoles as medicaments BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2005-01-20 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-20050014810-A1 Use of substituted 2 phenylbenzimidazoles as medicaments GLP1R, GIPR, GCGR KDM4E 2371/4885MEN1 733/4885KMT2A 2473/4885

“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.