SCHEMBL4568129

SCHEMBL4568129

CCc1ccc2c(Cc3cccc(C(=O)OC)c3)c(-c3ccccc3)n(C)c2c1

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.45
ALDH1A1 P00352 2/20 0.45
GLA P06280 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
DHFR P00374 3/20 0.45
PPARG P37231 2/20 0.43
LOXL2 Q9Y4K0 1/20 0.43
MAPK8 P45983 1/20 0.42
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
CYP4F2 P78329 2/20 0.42
CYP4A11 Q02928 2/20 0.42
MAPK10 P53779 1/20 0.41
SLC7A5 Q01650 1/20 0.41
PTGDR2 Q9Y5Y4 1/20 0.40
MAPT P10636 1/20 0.40
TSHR P16473 1/20 0.40
HIF1A Q16665 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
SCHEMBL4568156 0.91 PPARG (0.45) HPGDALDH1A1DHFRPPARG
SCHEMBL3711868 0.89 MAPK8 (0.49) HPGDALDH1A1GLATDP1L3MBTL1
SCHEMBL4568111 0.89 MEN1 (0.48) HPGDALDH1A1GLATDP1L3MBTL1
SCHEMBL4568133 0.86 MRGPRX4 (0.47) HPGDALDH1A1GLATDP1L3MBTL1
SCHEMBL4568136 0.85 MRGPRX4 (0.51) HPGDALDH1A1GLATDP1L3MBTL1
SCHEMBL4568130 0.81 MEN1 (0.40) HPGDALDH1A1GLATDP1L3MBTL1
SCHEMBL4568144 0.80 PPARG (0.51) PPARGMEN1KMT2A
SCHEMBL15998618 0.79 ENPP2 (0.46) HPGDALDH1A1PPARGMAPT
SCHEMBL4568145 0.78 ENPP2 (0.57) PPARG
SCHEMBL4568162 0.77 MRGPRX4 (0.49) PPARG

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 HPGD 1020/4885ALDH1A1 422/4885GLA 1892/4885

“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.