SCHEMBL4568159

SCHEMBL4568159

O=C(O)c1cccc(Cc2c(-c3ccccc3)[nH]c3cc(C(F)(F)F)ccc23)c1

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 5/20 0.46
PPARG P37231 1/20 0.44
TDO2 P48775 1/20 0.44
KIF11 P52732 1/20 0.43
CNR1 P21554 2/20 0.42
NR4A2 P43354 1/20 0.42
MAPK1 P28482 1/20 0.42
MAP2K4 P45985 1/20 0.42
MAPK6 Q16659 1/20 0.42
MAPKAPK5 Q8IW41 1/20 0.42
TMEM97 Q5BJF2 1/20 0.41
SIGMAR1 Q99720 1/20 0.41
GPR17 Q13304 1/20 0.41
MPL P40238 1/20 0.41
MAPT P10636 1/20 0.41

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
SCHEMBL4568115 0.89 MRGPRX4 (0.48) MRGPRX4KIF11CNR1TMEM97SIGMAR1
SCHEMBL4568132 0.86 MAP2K4 (0.50) MRGPRX4PPARGCNR1MAP2K4GPR17
SCHEMBL4568161 0.85 MRGPRX4 (0.51) MRGPRX4PPARGKIF11GPR17
SCHEMBL15998643 0.84 PPARG (0.47) MRGPRX4PPARGKIF11GPR17
SCHEMBL4572093 0.84 PPARG (0.46) MRGPRX4PPARGKIF11MAPK1MAP2K4
SCHEMBL4568139 0.84 MDM4 (0.58) MRGPRX4PPARGGPR17
SCHEMBL4568134 0.84 TUBB4A (0.57) MRGPRX4PPARGMAPT
SCHEMBL4568153 0.83 PPARG (0.51) PPARGKIF11GPR17
SCHEMBL3709905 0.81 TUBB4A (0.53) MRGPRX4PPARGGPR17
SCHEMBL4568172 0.81 MRGPRX4 (0.44) MRGPRX4PPARGCNR1GPR17

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-2474530-B1 INDOLE DERIVATIVE AND PHARMACOLOGICALLY ACCEPTABLE SALT THEREOF KISSEI PHARMACEUTICAL (JP) 2014-09-03 EP disclosed
EP-2474530-A1 INDOLE DERIVATIVE AND PHARMACOLOGICALLY ACCEPTABLE SALT THEREOF Kissei Pharmaceutical Co., Ltd. (JP) 2012-07-11 EP disclosed
US-20120122931-A1 INDOLE DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF KISSEI PHARMACEUTICAL CO., LTD. (JP) 2012-05-17 US disclosed
US-20120122931-A1 INDOLE DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF KISSEI PHARMACEUTICAL CO., LTD. (JP) 2012-05-17 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-20120122931-A1 INDOLE DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE SALT THEREOF PTGER1, CYSLTR1, LTB4R MRGPRX4 273/4885PPARG 500/4885TDO2 879/4885

“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.