SCHEMBL4568168

SCHEMBL4568168

Cc1ccc2c(Cc3cccc(C(=O)O)c3)c(C(C)(C)C)[nH]c2c1

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 5/20 0.48
NR1H4 Q96RI1 2/20 0.41
EGFR P00533 1/20 0.41
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40
KIF11 P52732 1/20 0.40
FOLH1 Q04609 1/20 0.40
ENPP2 Q13822 1/20 0.39
GPR17 Q13304 1/20 0.39
MDM4 O15151 1/20 0.39
MDM2 Q00987 1/20 0.39
MEP1B Q16820 1/20 0.38

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
SCHEMBL4568120 0.88 RAB9A (0.47) MRGPRX4KIF11
SCHEMBL4568147 0.87 ENPP2 (0.48) MRGPRX4ENPP2GPR17
SCHEMBL4568165 0.87 GPR17 (0.43) MRGPRX4NR1H4KIF11FOLH1GPR17
SCHEMBL4568171 0.87 MEN1 (0.45) MRGPRX4NR1H4KIF11FOLH1GPR17
SCHEMBL4568146 0.85 MRGPRX4 (0.49) MRGPRX4NR1H4KDM4EGPR17MEP1B
SCHEMBL4568139 0.83 MDM4 (0.58) MRGPRX4KDM4EALDH1A1GPR17MDM4
SCHEMBL4568169 0.77 ENPP2 (0.41) MRGPRX4EGFRENPP2
SCHEMBL4568170 0.77 EGFR (0.41) EGFRALDH1A1
SCHEMBL4568118 0.76 RAB9A (0.47) MRGPRX4KIF11
SCHEMBL4568107 0.76 RAB9A (0.46) MRGPRX4KDM4EALDH1A1KIF11GPR17

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 273/4885NR1H4 616/4885EGFR 544/4885

“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.