SCHEMBL579598

SCHEMBL579598

NC(=O)c1c(F)n(-c2ccc(F)cc2)c2ccccc12

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
USP14 P54578 1/20 0.46
REN P00797 2/20 0.45
EGFR P00533 1/20 0.43
SRC P12931 1/20 0.43
ALDH1A1 P00352 1/20 0.39
HTR2A P28223 1/20 0.38
HTR2C P28335 1/20 0.38
KDM4E B2RXH2 2/20 0.38
ATM Q13315 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
METAP2 P50579 1/20 0.38
RORC P51449 1/20 0.38
LMNA P02545 1/20 0.38
MEN1 O00255 1/20 0.37
POLB P06746 1/20 0.37
KMT2A Q03164 1/20 0.37
HKDC1 Q2TB90 1/20 0.37

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
SCHEMBL579199 0.91 KDM4E (0.48) RENEGFRSRCALDH1A1HTR2A
SCHEMBL17883617 0.90 HKDC1 (0.43) USP14RENEGFRSRCKDM4E
SCHEMBL27286483 0.79 KDM4E (0.45) USP14RENKDM4EATML3MBTL1
SCHEMBL4565589 0.78 EGFR (0.42) RENEGFRSRCALDH1A1HTR2A
SCHEMBL18614818 0.76 EGFR (0.49) EGFRSRCALDH1A1HTR2AHTR2C
SCHEMBL28246991 0.74 EGFR (0.64) EGFRSRCALDH1A1HTR2AHTR2C
SCHEMBL29385 0.74 KDM4E (0.67) USP14RENALDH1A1KDM4EATM
SCHEMBL9935958 0.72 LMNA (0.54) EGFRSRCALDH1A1KDM4ELMNA
SCHEMBL27494618 0.72 RECQL (0.56) USP14ALDH1A1KDM4ELMNAMEN1
SCHEMBL28295413 0.72 GAA (0.55) USP14EGFRSRCALDH1A1KDM4E

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
US-8735414-B2 Indole derivatives and methods for antiviral treatment PTC THERAPEUTICS, INC. (US) 2014-05-27 US disclosed
US-20120184574-A1 INDOLE DERIVATIVES AND METHODS FOR ANTIVIRAL TREATMENT PTC THERAPEUTICS, INC. (US) 2012-07-19 US disclosed
EP-2417122-A1 INDOLE DERIVATIVES AND METHODS FOR ANTIVIRAL TREATMENT PTC Therapeutics, Inc. (US) 2012-02-15 EP disclosed
WO-2010117932-A1 INDOLE DERIVATIVES AND METHODS FOR ANTIVIRAL TREATMENT SCHERING CORPORATION (US) 2010-10-14 WO 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-20120184574-A1 INDOLE DERIVATIVES AND METHODS FOR ANTIVIRAL TREATMENT IDO1, IRF3, MAVS USP14 831/4885REN 3437/4885EGFR 3083/4885

“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.