SCHEMBL2499800

SCHEMBL2499800

CC(=O)c1ccc(Cc2ccccc2C(=O)O)cc1C(F)F

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.51
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43
CA9 Q16790 1/20 0.43
CYP2C9 P11712 1/20 0.41
HIF1A Q16665 1/20 0.41
PTPN1 P18031 4/20 0.40
HNF4A P41235 1/20 0.38
FOLH1 Q04609 2/20 0.38
RXRA P19793 1/20 0.37
CFD P00746 1/20 0.37
PTPN2 P17706 1/20 0.37
PTPN6 P29350 1/20 0.37
PTGER4 P35408 1/20 0.37
CAPN1 P07384 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
SCHEMBL2498231 0.83 TSHR (0.50) TSHRCA1CA2CA9CYP2C9
SCHEMBL2500710 0.83 TSHR (0.52) TSHRCA1CA2CA9CYP2C9
SCHEMBL2502814 0.82 TSHR (0.44) TSHRCA1CA2CA9CYP2C9
SCHEMBL15959651 0.75 TSHR (0.58) TSHRCA1CA2CA9CYP2C9
SCHEMBL14523913 0.74 LMNA (0.43) TSHR
Acetic Acid SCHEMBL28245857 0.73 TSHR (0.71) TSHRCA1CA2CA9CYP2C9
SCHEMBL2500691 0.72 TSHR (0.52) TSHRCA1CA2CA9CYP2C9
SCHEMBL2499033 0.72 TSHR (0.46) TSHRCA1CA2CA9CYP2C9
SCHEMBL1044513 0.71 TSHR (0.58) TSHRCYP2C9HIF1APTPN1CAPN1
SCHEMBL16670764 0.71 TSHR (0.63) TSHRCA1CA2CA9CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1813613-B1 NOVEL FUSED IMIDAZOLE DERIVATIVE MSD KK (JP) 2012-12-19 EP disclosed
US-8030327-B2 3-[1-(2-chlorophenyl)ethoxy]-5-imidazo[1,2-a]pyridin-3-ylthiophene-2-carboxyamide; polo like kinase inhibitor; antitumor and anticarcinogenic agent; mitotic phase (M phase) of the cell cycle MDS K.K. (JP) 2011-10-04 US disclosed
US-20080103136-A1 Novel Fused Imidazole Derivative MSD K.K. (JP) 2008-05-01 US disclosed
EP-1813613-A1 NOVEL FUSED IMIDAZOLE DERIVATIVE BANYU PHARMACEUTICAL CO., LTD. (JP) 2007-08-01 EP 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-20080103136-A1 Novel Fused Imidazole Derivative HRH4, H1-4, H1-3 TSHR 738/4885CA1 3116/4885CA2 1544/4885

“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.