SCHEMBL2353690

SCHEMBL2353690

COc1cc(-c2cnn(C)c2)cn2ncc(CNc3ccc4[nH]c(=O)[nH]c4c3)c12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 12/20 0.49
MAPT P10636 6/20 0.49
KDM4E B2RXH2 4/20 0.49
LMNA P02545 2/20 0.49
MAPK1 P28482 2/20 0.49
GFER P55789 1/20 0.49
KMT2A Q03164 9/20 0.44
MEN1 O00255 6/20 0.44
ALDH1A1 P00352 2/20 0.44
POLB P06746 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
G6PD P11413 1/20 0.44
L3MBTL1 Q9Y468 3/20 0.43
TP53 P04637 1/20 0.42
NTRK1 P04629 1/20 0.42
NTRK2 Q16620 1/20 0.42
FGFR3 P22607 1/20 0.42
KDR P35968 1/20 0.42
HPGD P15428 1/20 0.41
ALOX15 P16050 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
SCHEMBL2355340 0.85 FGFR3 (0.46) MAPTKDM4EMAPK1KMT2AMEN1
SCHEMBL2351994 0.84 KDM4E (0.44) MAPTKDM4EKMT2AMEN1ALDH1A1
SCHEMBL1908395 0.83 FGFR3 (0.47) GAAMAPTKDM4ELMNAKMT2A
SCHEMBL2354627 0.82 FGFR3 (0.44) FGFR3KDR
SCHEMBL2353665 0.82 FGFR3 (0.44) NTRK1NTRK2FGFR3KDR
SCHEMBL2353033 0.81 RET (0.45) NTRK1NTRK2FGFR3KDR
SCHEMBL1906737 0.80 FGFR3 (0.41) FGFR3KDR
SCHEMBL2350172 0.80 FGFR3 (0.44) FGFR3KDR
SCHEMBL13509608 0.80 FGFR3 (0.44) NTRK1NTRK2FGFR3KDR
SCHEMBL1908240 0.80 FGFR3 (0.44) FGFR3KDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8455477-B2 Therapeutic compounds MERCK SHARP & DOHME CORP. (US) 2013-06-04 US claimed
US-20110207711-A1 Therapeutic Compounds MSD K.K. (JP) 2011-08-25 US claimed
US-8455477-B2 Therapeutic compounds MERCK SHARP & DOHME CORP. (US) 2013-06-04 US disclosed
US-8455477-B2 Therapeutic compounds MERCK SHARP & DOHME CORP. (US) 2013-06-04 US disclosed
US-8455477-B2 Therapeutic compounds MERCK SHARP & DOHME CORP. (US) 2013-06-04 US disclosed
US-20110207711-A1 Therapeutic Compounds MSD K.K. (JP) 2011-08-25 US disclosed
US-20110207711-A1 Therapeutic Compounds MSD K.K. (JP) 2011-08-25 US disclosed
US-20110207711-A1 Therapeutic Compounds MSD K.K. (JP) 2011-08-25 US disclosed
WO-2010017047-A1 THERAPEUTIC COMPOUNDS MERCK & CO., INC. (US) 2010-02-11 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-20110207711-A1 Therapeutic Compounds WEE2, MARK3, WEE1 GAA 2408/4885MAPT 90/4885KDM4E 1778/4885

“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.