SCHEMBL12665133

SCHEMBL12665133

CC(C)c1ccc2c(c1)c(-c1ccc[nH]c1=O)c(C(=O)O)n2Cc1ccccc1F

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYP2C8 P10632 1/20 0.54
YWHAH Q04917 2/20 0.48
KMT2A Q03164 3/20 0.46
KDM4E B2RXH2 3/20 0.39
ALDH1A1 P00352 2/20 0.39
PTGES2 Q9H7Z7 1/20 0.37
MEN1 O00255 1/20 0.37
GNRHR P30968 2/20 0.37
TSHR P16473 2/20 0.36
LMNA P02545 1/20 0.36
MAPK1 P28482 1/20 0.36
HTT P42858 1/20 0.36
HSD17B10 Q99714 1/20 0.36
TP53 P04637 1/20 0.36
PTGDR2 Q9Y5Y4 2/20 0.35
PKM P14618 1/20 0.35

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
SCHEMBL12665049 0.88 CYP2C8 (0.58) CYP2C8KMT2AKDM4EALDH1A1MEN1
SCHEMBL830714 0.87 CYP2C8 (0.42) CYP2C8YWHAHKMT2AKDM4EALDH1A1
SCHEMBL12665296 0.87 CYP2C8 (0.42) CYP2C8YWHAHKMT2AMEN1LMNA
SCHEMBL12673827 0.86 CYP2C8 (0.55) CYP2C8YWHAHKMT2AKDM4EALDH1A1
SCHEMBL12665291 0.86 CYP2C8 (0.54) CYP2C8YWHAHKMT2AKDM4EALDH1A1
SCHEMBL12665111 0.86 CYP2C8 (0.62) CYP2C8YWHAHKMT2AKDM4EALDH1A1
SCHEMBL12665206 0.85 CYP2C8 (0.54) CYP2C8YWHAHKMT2AKDM4EALDH1A1
SCHEMBL12673995 0.85 CYP2C8 (0.54) CYP2C8YWHAHKMT2ATP53
SCHEMBL12673730 0.84 CYP2C8 (0.53) CYP2C8YWHAHKMT2AKDM4EALDH1A1
SCHEMBL12665084 0.84 CYP2C8 (0.73) CYP2C8YWHAHKMT2AKDM4EALDH1A1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110104110-A1 SUBSTITUTED INDOLE DERIVATIVES AND METHODS OF USE THEREOF SHERING CORPORATION 2011-05-05 US disclosed
US-20110104110-A1 SUBSTITUTED INDOLE DERIVATIVES AND METHODS OF USE THEREOF SHERING CORPORATION 2011-05-05 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-20110104110-A1 SUBSTITUTED INDOLE DERIVATIVES AND METHODS OF USE THEREOF IDO1, IDO2, INMT CYP2C8 457/4885YWHAH 126/4885KMT2A 537/4885

“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.