SCHEMBL1919487

SCHEMBL1919487

CCOC(=O)c1sc(Br)nc1Cc1ccc(-c2ccccc2)cc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDC7 O00311 5/20 0.58
DBF4 Q9UBU7 5/20 0.58
TRPM8 Q7Z2W7 5/20 0.58
ALDH1A1 P00352 4/20 0.52
HPGD P15428 3/20 0.52
HSD17B10 Q99714 2/20 0.51
RARA P10276 1/20 0.51
RARB P10826 1/20 0.51
RARG P13631 1/20 0.51
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
DHODH Q02127 1/20 0.47
CYP1A2 P05177 1/20 0.47
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47
MAPT P10636 3/20 0.47
KDM4E B2RXH2 3/20 0.47
GAA P10253 1/20 0.47
MAPK1 P28482 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47

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
SCHEMBL1918920 0.92 CDC7 (0.56) CDC7DBF4TRPM8ALDH1A1HPGD
SCHEMBL2692437 0.86 CDC7 (0.49) CDC7DBF4TRPM8ALDH1A1RARA
SCHEMBL623716 0.85 MAPT (0.58) CDC7DBF4TRPM8ALDH1A1HPGD
SCHEMBL2690687 0.85 PTPN11 (0.55) CDC7DBF4TRPM8ALDH1A1HPGD
SCHEMBL5528919 0.85 TRPM8 (0.55) CDC7DBF4TRPM8ALDH1A1HPGD
SCHEMBL1919769 0.84 DHODH (0.50) CDC7DBF4TRPM8ALDH1A1HPGD
SCHEMBL1920626 0.84 PTPN11 (0.51) CDC7DBF4TRPM8ALDH1A1MAPT
SCHEMBL1919045 0.82 MEN1 (0.61) CDC7DBF4TRPM8ALDH1A1MEN1
SCHEMBL1919038 0.81 ALDH1A1 (0.46) CDC7DBF4TRPM8ALDH1A1HPGD
SCHEMBL2690624 0.81 PTPN11 (0.48) CDC7DBF4TRPM8HSD17B10CYP1A2

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-20120108565-A1 PYRROLE CARBOXYLIC ACID DERIVATIVES AS ANTIBACTERIAL AGENTS RANBAXY LABORATORIES LIMITED (IN) 2012-05-03 US disclosed
EP-2326640-A1 PYRROLE CARBOXYLIC ACID DERIVATIVES AS ANTIBACTERIAL AGENTS Ranbaxy Laboratories Limited (IN) 2011-06-01 EP disclosed
WO-2010013222-A1 PYRROLE CARBOXYLIC ACID DERIVATIVES AS ANTIBACTERIAL AGENTS RANBAXY LABORATORIES LIMITED (IN) 2010-02-04 WO 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-20120108565-A1 PYRROLE CARBOXYLIC ACID DERIVATIVES AS ANTIBACTERIAL AGENTS POLI, POLB, POLA1 CDC7 1875/4885DBF4 3789/4885TRPM8 3522/4885

“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.