SCHEMBL12665809

SCHEMBL12665809

CCc1ccc2c(c1)c(-c1ccc[nH]c1=O)c(C(C)=O)n2Cc1cc([N+](=O)[O-])ccc1F

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CYP2C8 P10632 1/20 0.41
PLA2G2A P14555 1/20 0.35
KMT2A Q03164 6/20 0.35
S1PR3 Q99500 2/20 0.34
MEN1 O00255 3/20 0.34
MAPT P10636 2/20 0.34
LMNA P02545 1/20 0.34
KDM4E B2RXH2 1/20 0.34
GAA P10253 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
CYP3A4 P08684 1/20 0.33
ABCC1 P33527 1/20 0.33
NOX4 Q9NPH5 1/20 0.33
CDK2 P24941 1/20 0.33
P2RX4 Q99571 1/20 0.32

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
SCHEMBL12665273 0.94 CYP2C8 (0.48) CYP2C8PLA2G2AKMT2AS1PR3MEN1
SCHEMBL13906260 0.92 CYP2C8 (0.40) CYP2C8PLA2G2AKMT2AS1PR3MEN1
SCHEMBL12665816 0.91 CYP2C8 (0.40) CYP2C8PLA2G2AKMT2AMEN1MAPT
SCHEMBL12665807 0.90 CYP2C8 (0.43) CYP2C8PLA2G2AKMT2AMEN1MAPT
SCHEMBL832281 0.89 CYP2C8 (0.38) CYP2C8PLA2G2AKMT2AS1PR3MEN1
SCHEMBL12665817 0.88 CYP2C8 (0.40) CYP2C8KMT2AMEN1MAPTLMNA
SCHEMBL12665811 0.87 CYP2C8 (0.54) CYP2C8PLA2G2AKMT2AS1PR3MEN1
SCHEMBL12665805 0.87 CYP2C8 (0.45) CYP2C8KMT2AMEN1MAPTKDM4E
SCHEMBL832072 0.86 CYP2C8 (0.36) CYP2C8PLA2G2AKMT2AS1PR3
SCHEMBL13906262 0.85 CYP2C8 (0.47) CYP2C8PLA2G2AKMT2AMEN1LMNA

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 1 patent. 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

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 457/4885PLA2G2A 4022/4885KMT2A 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.