SCHEMBL4322158

SCHEMBL4322158

CC(Br)c1ccc(C=CC(=O)O)cc1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.73
MAPK1 P28482 3/20 0.73
HCAR2 Q8TDS4 2/20 0.55
CA12 O43570 2/20 0.55
AKR1B10 O60218 2/20 0.55
CA1 P00915 2/20 0.55
CA2 P00918 2/20 0.55
CA3 P07451 2/20 0.55
AKR1B1 P15121 2/20 0.55
CA4 P22748 2/20 0.55
CA6 P23280 2/20 0.55
DPP4 P27487 2/20 0.55
CA5A P35218 2/20 0.55
CA7 P43166 2/20 0.55
CA9 Q16790 2/20 0.55
CA14 Q9ULX7 2/20 0.55
CA5B Q9Y2D0 2/20 0.55
ESR1 P03372 2/20 0.55
ESR2 Q92731 2/20 0.55
PKM P14618 1/20 0.55

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
SCHEMBL7140088 1.00 KDM4E (0.73) KDM4EMAPK1HCAR2CA12AKR1B10
SCHEMBL819055 0.85 KDM4E (1.00) KDM4EMAPK1HCAR2CA12AKR1B10
SCHEMBL1711780 0.85 KDM4E (1.00) KDM4EMAPK1HCAR2CA12AKR1B10
SCHEMBL11683046 0.83 KDM4E (0.76) KDM4EMAPK1HCAR2CA12AKR1B10
SCHEMBL28002416 0.81 KDM4E (0.73) KDM4EMAPK1HCAR2CA12AKR1B10
SCHEMBL12814412 0.81 KDM4E (0.73) KDM4EMAPK1HCAR2CA12AKR1B10
SCHEMBL28948630 0.81 CA12 (0.62) KDM4EMAPK1CA12AKR1B10CA1
SCHEMBL3156394 0.80 KDM4E (0.71) KDM4EMAPK1HCAR2CA12AKR1B10
SCHEMBL713717 0.79 HCAR2 (0.81) KDM4EMAPK1HCAR2CA12AKR1B10
SCHEMBL68395 0.79 HCAR2 (0.81) KDM4EMAPK1HCAR2CA12AKR1B10

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
CN-104371071-A Preparation method for hyperbranched polycarboxylic-acid concrete efficient water reducer JIANGSU SUBOTE NEW MAT CO LTD 2015-02-25 CN disclosed
WO-2009144201-A1 IMIDAZOPYRIDINE DERIVATIVES AS GPR4 RECEPTOR MODULATORS NOVARTIS AG (CH) 2009-12-03 WO disclosed
US-20090291942-A1 IMIDAZO PYRIDINE DERIVATIVES TARACIDO IVAN CORNELLA 2009-11-26 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-20090291942-A1 IMIDAZO PYRIDINE DERIVATIVES FLT4, UACA, FLT1 KDM4E 1742/4885MAPK1 872/4885HCAR2 334/4885

“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.