SCHEMBL4568147

SCHEMBL4568147

CC(C)(C)c1[nH]c2cc(Cl)ccc2c1Cc1cccc(C(=O)O)c1

nearest known ligand 0.48

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 2/20 0.48
MRGPRX4 Q96LA9 6/20 0.45
PDE5A O76074 1/20 0.44
GPR17 Q13304 1/20 0.44
AR P10275 1/20 0.43

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
SCHEMBL4568110 0.88 RAB9A (0.49) MRGPRX4
SCHEMBL4568168 0.87 MRGPRX4 (0.48) ENPP2MRGPRX4GPR17
SCHEMBL4568171 0.86 MEN1 (0.45) MRGPRX4GPR17
SCHEMBL4568165 0.86 GPR17 (0.43) MRGPRX4GPR17
SCHEMBL4568146 0.84 MRGPRX4 (0.49) MRGPRX4GPR17
SCHEMBL4568134 0.82 TUBB4A (0.57) ENPP2MRGPRX4
SCHEMBL4568225 0.78 TUBB4A (0.48) ENPP2MRGPRX4PDE5A
SCHEMBL4568163 0.78 ENPP2 (0.50) ENPP2MRGPRX4
SCHEMBL4568152 0.77 GPR17 (0.44) MRGPRX4GPR17
SCHEMBL4568221 0.77 TUBB4A (0.47) ENPP2MRGPRX4PDE5A

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-2474530-B1 INDOLE DERIVATIVE AND PHARMACOLOGICALLY ACCEPTABLE SALT THEREOF KISSEI PHARMACEUTICAL (JP) 2014-09-03 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 ENPP2 595/4885MRGPRX4 273/4885PDE5A 1803/4885

“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.