SCHEMBL4568136

SCHEMBL4568136

COC(=O)c1cccc(Cc2c(-c3ccccc3)n(C)c3cc(OC(F)(F)F)ccc23)c1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 2/20 0.51
PPARG P37231 9/20 0.43
PPARA Q07869 4/20 0.43
ALDH1A1 P00352 1/20 0.42
GLA P06280 1/20 0.42
HPGD P15428 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
NR1H2 P55055 1/20 0.42
NR1H3 Q13133 1/20 0.42
ROCK2 O75116 1/20 0.42
TRPC5 Q9UL62 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
SERPINE1 P05121 1/20 0.41
PTPN11 Q06124 1/20 0.40

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
SCHEMBL4568162 0.93 MRGPRX4 (0.49) MRGPRX4PPARGPPARAROCK2TRPC5
SCHEMBL4568111 0.91 MEN1 (0.48) PPARGALDH1A1GLAHPGDTDP1
SCHEMBL4568133 0.88 MRGPRX4 (0.47) MRGPRX4PPARGALDH1A1GLAHPGD
SCHEMBL4568129 0.85 HPGD (0.45) PPARGALDH1A1GLAHPGDTDP1
SCHEMBL3711868 0.85 MAPK8 (0.49) MRGPRX4PPARGALDH1A1GLAHPGD
SCHEMBL4568144 0.82 PPARG (0.51) MRGPRX4PPARGMEN1KMT2A
SCHEMBL4568116 0.79 MRGPRX4 (0.52) MRGPRX4NR1H2NR1H3
SCHEMBL4568156 0.76 PPARG (0.45) PPARGALDH1A1HPGD
SCHEMBL15998618 0.75 ENPP2 (0.46) MRGPRX4PPARGALDH1A1HPGD
SCHEMBL4568145 0.74 ENPP2 (0.57) MRGPRX4PPARG

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-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 500/4885PPARA 474/4885

“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.