SCHEMBL9610077

SCHEMBL9610077

Cc1cc(N)c(Cl)c(C(F)(F)F)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.39
RAPGEF4 Q8WZA2 2/20 0.37
FFAR4 Q5NUL3 2/20 0.36
ALDH1A1 P00352 5/20 0.34
GAA P10253 2/20 0.34
KDM4E B2RXH2 1/20 0.34
LMNA P02545 1/20 0.34
MAPT P10636 1/20 0.34
TSHR P16473 2/20 0.33
TDP1 Q9NUW8 2/20 0.33
POLB P06746 2/20 0.33
ALOX15 P16050 2/20 0.33
AR P10275 1/20 0.33
GLA P06280 1/20 0.33
TP53 P04637 1/20 0.33
CYP3A4 P08684 1/20 0.33
THRB P10828 1/20 0.33
FFAR1 O14842 1/20 0.33
CA2 P00918 2/20 0.32
CA12 O43570 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
SCHEMBL15517270 0.84 RAPGEF4 (0.42) SMN1; SMN2RAPGEF4ALDH1A1MAPTTSHR
SCHEMBL1039804 0.78 RAPGEF4 (0.50) SMN1; SMN2RAPGEF4FFAR4ALDH1A1LMNA
SCHEMBL15761590 0.78 SMN1; SMN2 (0.41) SMN1; SMN2RAPGEF4FFAR4ALDH1A1GAA
SCHEMBL10493689 0.78 RAPGEF4 (0.42) SMN1; SMN2RAPGEF4ALDH1A1MAPTPOLB
SCHEMBL1040870 0.78 TSHR (0.45) SMN1; SMN2FFAR4ALDH1A1GAAKDM4E
SCHEMBL10776564 0.78 CYP3A4 (0.41) SMN1; SMN2FFAR4ALDH1A1GAATSHR
SCHEMBL15850774 0.78 SMN1; SMN2 (0.41) SMN1; SMN2RAPGEF4FFAR4ALDH1A1GAA
SCHEMBL24343525 0.77 SMN1; SMN2 (0.40) SMN1; SMN2RAPGEF4FFAR4ALDH1A1GAA
SCHEMBL9560970 0.77 EPAS1 (0.37) FFAR4GAATSHRPOLBGLA
SCHEMBL1041159 0.77 SMN1; SMN2 (0.46) SMN1; SMN2RAPGEF4ALDH1A1KDM4EMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8372807-B2 Methods of modulating uric acid levels ARDEA BIOSCIENCES, INC. (US) 2013-02-12 US disclosed
US-8372807-B2 Methods of modulating uric acid levels ARDEA BIOSCIENCES, INC. (US) 2013-02-12 US disclosed
US-8198458-B2 Non-nucleoside reverse transcriptase inhibitors BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-06-12 US disclosed
US-8198458-B2 Non-nucleoside reverse transcriptase inhibitors BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-06-12 US disclosed
US-20120135929-A1 Methods Of Modulating Uric Acid Levels ARDEA BIOSCIENCES INC. (US) 2012-05-31 US disclosed
US-20120135929-A1 Methods Of Modulating Uric Acid Levels ARDEA BIOSCIENCES INC. (US) 2012-05-31 US disclosed
WO-2010135536-A2 METHODS OF MODULATING URIC ACID LEVELS ARDEA BIOSCIENCES, INC. (US) 2010-11-25 WO disclosed
US-20090143370-A1 Non-nucleoside Reverse Transcriptase Inhibitors BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2009-06-04 US disclosed
US-7517998-B2 Benzothiazole or benzothiazine derivative of dipyrido(2,3;b:2',3'-e) diazepin-6-one; viricide against human t-cell leukemia/lymphoma virus BOEHRINGER INGELHEIM INTERNATIONAL GMBH 2009-04-14 US disclosed
US-7517998-B2 Benzothiazole or benzothiazine derivative of dipyrido(2,3;b:2',3'-e) diazepin-6-one; viricide against human t-cell leukemia/lymphoma virus BOEHRINGER INGELHEIM INTERNATIONAL GMBH 2009-04-14 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 (2 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-20120135929-A1 Methods Of Modulating Uric Acid Levels XDH, PON1, OAT SMN1; SMN2 1281/4885RAPGEF4 4443/4885FFAR4 2276/4885
US-20090143370-A1 Non-nucleoside Reverse Transcriptase Inhibitors RTF1, POLR1A, POLR1E SMN1; SMN2 1896/4885RAPGEF4 3676/4885FFAR4 3312/4885

“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.