SCHEMBL5379958

SCHEMBL5379958

N#CC1(c2cc(F)cc(C(F)(F)F)c2)CCN(C(=O)O)CC1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
S1PR2 O95136 4/20 0.42
CA12 O43570 2/20 0.38
CA1 P00915 2/20 0.38
CA2 P00918 2/20 0.38
CA9 Q16790 2/20 0.38
FFAR4 Q5NUL3 1/20 0.38
CA7 P43166 1/20 0.37
CA14 Q9ULX7 1/20 0.37
HIF1A Q16665 1/20 0.36
CYP3A4 P08684 2/20 0.36
TSHR P16473 1/20 0.36
IDO1 P14902 1/20 0.36
TDO2 P48775 1/20 0.36
USP2 O75604 4/20 0.35
CYP2D6 P10635 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
HSD17B10 Q99714 1/20 0.35
CYP2C19 P33261 2/20 0.35
CHRM4 P08173 1/20 0.35
CYP1A2 P05177 1/20 0.34

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
SCHEMBL5379997 0.88 CA12 (0.43) CA12CA1CA2CA9CA7
SCHEMBL3131938 0.82 CA12 (0.46) CA12CA1CA2CA9CA7
SCHEMBL3491179 0.82 CA12 (0.39) CA12CA1CA2CA9CA7
SCHEMBL5376588 0.82 CA12 (0.47) CA12CA1CA2CA9CA7
SCHEMBL5367535 0.82 S1PR2 (0.57) S1PR2FFAR4HIF1ACYP3A4TSHR
SCHEMBL624106 0.80 CYP1A2 (0.33) S1PR2SMN1; SMN2CYP1A2
SCHEMBL2428794 0.77 CA12 (0.50) CA12CA1CA2CA9CA7
SCHEMBL12369416 0.76 TSHR (0.37) CYP3A4TSHRCYP2D6
Bromide SCHEMBL2272283 0.75 TSHR (0.36) CYP3A4TSHRCYP2D6
SCHEMBL12369470 0.74 MAPK10 (0.48) S1PR2USP2CYP1A2

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
EP-1714961-B1 INDAZOLE COMPOUND AND PHARMACEUTICAL USE THEREOF MITSUBISHI TANABE PHARMA CORP (JP) 2015-12-09 EP disclosed
US-20070173537-A1 Indazole compound and pharmaceutical use thereof MITSUBISHI PHARMA CORPORATION (JP) 2007-07-26 US disclosed
EP-1714961-A1 INDAZOLE COMPOUND AND PHARMACEUTICAL USE THEREOF Mitsubishi Pharma Corporation (JP) 2006-10-25 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-20070173537-A1 Indazole compound and pharmaceutical use thereof CYP3A5, CYP3A43, TP53 S1PR2 4307/4885CA12 623/4885CA1 1034/4885

“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.