SCHEMBL5571369

SCHEMBL5571369

Nc1ccc(F)cc1.Nc1ccc(O)c(F)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
PDE10A Q9Y233 1/20 0.45
CA3 P07451 2/20 0.43
CA6 P23280 2/20 0.43
CA14 Q9ULX7 2/20 0.43
CA5A P35218 1/20 0.43
CA9 Q16790 1/20 0.43
CA5B Q9Y2D0 1/20 0.43
ALDH1A1 P00352 4/20 0.41
CASP1 P29466 3/20 0.41
ALOX15 P16050 3/20 0.41
HSD17B10 Q99714 3/20 0.41
TDP1 Q9NUW8 2/20 0.41
CYP3A4 P08684 2/20 0.41
THRB P10828 2/20 0.41
HIF1A Q16665 2/20 0.41
MAPK1 P28482 2/20 0.41
LMNA P02545 1/20 0.41
MAPT P10636 1/20 0.41

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
SCHEMBL33713 0.91
Hydrochloric Acid SCHEMBL2534896 0.89 CA1 (0.50) CA1CA2PDE10AALDH1A1CASP1
SCHEMBL29619760 0.76
SCHEMBL185204 0.76
SCHEMBL28865604 0.75 MAPT (0.61) CA1CA2CA3CA6CA14
SCHEMBL8466839 0.75 MAPT (0.61) CA1CA2CA3CA6CA14
SCHEMBL3199 0.75
SCHEMBL18867937 0.75
SCHEMBL6573823 0.75 PDE10A (0.47) CA1CA2PDE10AALDH1A1CASP1
3-Aminophenol SCHEMBL28161683 0.75 ALDH1A1 (0.61) CA1CA2CA3CA6CA14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200331860-A1 C-Met Modulators and Methods of Use EXELIXIS INC (US) 2020-10-22 US disclosed
US-20150376133-A1 C-Met Modulators and Methods of Use EXELIXIS, INC. 2015-12-31 US disclosed
US-20140155378-A9 c-Met Modulators and Method of Use EXELIXIS, INC. (US) 2014-06-05 US disclosed
US-20130252940-A1 c-Met Modulators and Method of Use EXELIXIS, INC. (US) 2013-09-26 US disclosed
US-8497284-B2 C-met modulators and method of use EXELIXIS, INC. (US) 2013-07-30 US disclosed
US-8476298-B2 c-Met modulators and method of use EXELIXIS, INC. (US) 2013-07-02 US disclosed
US-20070244116-A1 c-MET MODULATORS AND METHOD OF USE EXELIXIS, INC. (US) 2007-10-18 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 (5 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-20200331860-A1 C-Met Modulators and Methods of Use FLT4, FLT1, MET CA1 3329/4885CA2 1724/4885PDE10A 1426/4885
US-20140155378-A9 c-Met Modulators and Method of Use FLT4, MET, FLT1 CA1 3144/4885CA2 1932/4885PDE10A 1725/4885
US-20150376133-A1 C-Met Modulators and Methods of Use FLT4, FLT1, MET CA1 3329/4885CA2 1724/4885PDE10A 1426/4885
US-20070244116-A1 c-MET MODULATORS AND METHOD OF USE FLT4, MET, FLT1 CA1 3144/4885CA2 1932/4885PDE10A 1725/4885
US-20130252940-A1 c-Met Modulators and Method of Use FLT4, MET, FLT1 CA1 3144/4885CA2 1932/4885PDE10A 1725/4885

“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.