SCHEMBL14726481

SCHEMBL14726481

Nc1nc(-c2ccccc2OC(F)(F)F)cs1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MPL P40238 5/20 0.76
SCN9A Q15858 9/20 0.53
HSD17B10 Q99714 2/20 0.53
CYP2C9 P11712 2/20 0.51
CYP3A4 P08684 2/20 0.51
CYP2D6 P10635 1/20 0.51
ALDH1A1 P00352 5/20 0.46
RAB9A P51151 3/20 0.44
KDM4E B2RXH2 2/20 0.44
MEN1 O00255 2/20 0.44
MAPT P10636 2/20 0.44
KMT2A Q03164 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
NPC1 O15118 1/20 0.44
LMNA P02545 1/20 0.44
NFKB1 P19838 1/20 0.44
NFKB2 Q00653 1/20 0.44
RELA Q04206 1/20 0.44
ALOX5 P09917 1/20 0.44
THRB P10828 1/20 0.43

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
SCHEMBL4876821 0.87 MPL (1.00) MPLSCN9AHSD17B10CYP2C9CYP3A4
SCHEMBL1915828 0.80 SCN9A (0.52) MPLSCN9ACYP2C9CYP3A4CYP2D6
SCHEMBL10275178 0.79 MPL (0.77) MPLSCN9AHSD17B10CYP2C9CYP3A4
SCHEMBL29796690 0.79 ALDH1A1 (0.63) MPLHSD17B10ALDH1A1RAB9AKDM4E
SCHEMBL234658 0.79 ALDH1A1 (0.63) MPLHSD17B10ALDH1A1RAB9AKDM4E
Iodide SCHEMBL11486465 0.78 ALDH1A1 (0.61) MPLHSD17B10ALDH1A1RAB9AKDM4E
SCHEMBL10315632 0.76 MPL (0.60) MPLSCN9AHSD17B10CYP2C9CYP3A4
SCHEMBL30122919 0.76 MPL (0.74) MPLHSD17B10CYP3A4ALDH1A1RAB9A
SCHEMBL5330380 0.76 MPL (0.74) MPLHSD17B10CYP3A4ALDH1A1RAB9A
SCHEMBL23364837 0.75 MPL (0.53) MPLHSD17B10CYP3A4ALDH1A1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170217923-A1 THERAPEUTIC COMPOUNDS AND RELATED METHODS OF USE OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2017-08-03 US disclosed
US-20170217923-A1 THERAPEUTIC COMPOUNDS AND RELATED METHODS OF USE OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2017-08-03 US disclosed
US-9630947-B2 Therapeutic compounds and related methods of use OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2017-04-25 US disclosed
US-20150307477-A1 THERAPEUTIC COMPOUNDS AND RELATED METHODS OF USE GALENEA CORPORATION 2015-10-29 US disclosed
US-20150307477-A1 THERAPEUTIC COMPOUNDS AND RELATED METHODS OF USE GALENEA CORPORATION 2015-10-29 US disclosed
US-9073890-B2 Therapeutic compounds and related methods of use OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2015-07-07 US disclosed
US-20130053341-A1 THERAPEUTIC COMPOUNDS AND RELATED METHODS OF USE OTSUKA PHARMACEUTICAL COMPANY (JP) 2013-02-28 US disclosed
US-20130053341-A1 THERAPEUTIC COMPOUNDS AND RELATED METHODS OF USE OTSUKA PHARMACEUTICAL COMPANY (JP) 2013-02-28 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 (3 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-20150307477-A1 THERAPEUTIC COMPOUNDS AND RELATED METHODS OF USE PPP4C, PTPRG, PPP2CA MPL 286/4885SCN9A 3949/4885HSD17B10 2489/4885
US-20130053341-A1 THERAPEUTIC COMPOUNDS AND RELATED METHODS OF USE PPP4C, PPP3CB, PTPRG MPL 645/4885SCN9A 3681/4885HSD17B10 2306/4885
US-20170217923-A1 THERAPEUTIC COMPOUNDS AND RELATED METHODS OF USE PPP4C, PTPRG, PPP2CA MPL 286/4885SCN9A 3949/4885HSD17B10 2489/4885

“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.