SCHEMBL5093208

SCHEMBL5093208

COc1ccc(-c2[nH]c(C=C(C(=O)O)c3ccc(C)cc3)nc2-c2ccc(Cl)c(Cl)c2)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.44
KDM4E B2RXH2 3/20 0.44
ALDH1A1 P00352 3/20 0.44
GLA P06280 3/20 0.44
GAA P10253 3/20 0.44
MEN1 O00255 2/20 0.44
HPGD P15428 2/20 0.44
KMT2A Q03164 2/20 0.44
CYP1A2 P05177 1/20 0.44
CYP2C19 P33261 1/20 0.44
GFER P55789 1/20 0.44
EGFR P00533 1/20 0.40
PPARD Q03181 1/20 0.38
AKR1C3 P42330 1/20 0.38
NOX1 Q9Y5S8 1/20 0.37
TP53 P04637 2/20 0.37
SMPD3 Q9NY59 2/20 0.37
MAPK13 O15264 1/20 0.37
RAF1 P04049 1/20 0.37
MAPK12 P53778 1/20 0.37

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
SCHEMBL5094382 1.00 MAPT (0.44) MAPTKDM4EALDH1A1GLAGAA
SCHEMBL5093190 1.00 MAPT (0.44) MAPTKDM4EALDH1A1GLAGAA
SCHEMBL5099031 0.93 MAPT (0.44) MAPTKDM4EALDH1A1GLAGAA
SCHEMBL5099038 0.93 MAPT (0.44) MAPTKDM4EALDH1A1GLAGAA
SCHEMBL5091344 0.91 MEN1 (0.41) MAPTKDM4EALDH1A1GLAGAA
SCHEMBL5091333 0.91 MEN1 (0.41) MAPTKDM4EALDH1A1GLAGAA
SCHEMBL5094335 0.91 MEN1 (0.41) MAPTKDM4EALDH1A1GLAGAA
SCHEMBL5091286 0.88 MAPT (0.42) MAPTKDM4EALDH1A1GLAGAA
SCHEMBL5091295 0.88 MAPT (0.42) MAPTKDM4EALDH1A1GLAGAA
SCHEMBL5098904 0.88 MAPT (0.42) MAPTKDM4EALDH1A1GLAGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7456208-B2 CCK-1 receptor modulators JANSSEN PHARMACEUTICA N.V. (BG) 2008-11-25 US claimed
US-20070249698-A1 CCK-1 Receptor Modulators JANSSEN PHARMACEUTICA N.V. (BE) 2007-10-25 US claimed
US-7250434-B2 CCK-1 receptor modulators JANSSEN PHARMACEUTICA N.V. (BE) 2007-07-31 US claimed
US-20050197377-A1 CCK-1 receptor modulators JANSSEN PHARMACEUTICA, N.V. (BE) 2005-09-08 US claimed
US-7456208-B2 CCK-1 receptor modulators JANSSEN PHARMACEUTICA N.V. (BG) 2008-11-25 US disclosed
US-20070249698-A1 CCK-1 Receptor Modulators JANSSEN PHARMACEUTICA N.V. (BE) 2007-10-25 US disclosed
US-7250434-B2 CCK-1 receptor modulators JANSSEN PHARMACEUTICA N.V. (BE) 2007-07-31 US disclosed
US-20050197377-A1 CCK-1 receptor modulators JANSSEN PHARMACEUTICA, N.V. (BE) 2005-09-08 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-20050197377-A1 CCK-1 receptor modulators CCKAR, CCKBR, GIPR MAPT 4128/4885KDM4E 4205/4885ALDH1A1 3320/4885
US-20070249698-A1 CCK-1 Receptor Modulators CCKAR, CCKBR, GIPR MAPT 4128/4885KDM4E 4205/4885ALDH1A1 3320/4885

“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.