SCHEMBL1077503

SCHEMBL1077503

Cc1noc2c1C(c1ccc3[nH]nc(C)c3c1)C(C#N)=C(C(F)F)N2

nearest known ligand 0.51

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MET P08581 17/20 0.51
RPS6KA3 P51812 1/20 0.38
ALDH1A1 P00352 3/20 0.36
KDM4E B2RXH2 1/20 0.36
LMNA P02545 1/20 0.36
MAPT P10636 1/20 0.36
ALOX12 P18054 1/20 0.36
HTT P42858 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL1078003 0.87 MET (0.49) METRPS6KA3ALDH1A1KDM4ELMNA
SCHEMBL1583435 0.86 MET (0.62) METRPS6KA3SMN1; SMN2
SCHEMBL1079941 0.85 MET (0.53) METALDH1A1SMN1; SMN2
SCHEMBL1583727 0.83 MET (0.71) METRPS6KA3ALDH1A1KDM4EMAPT
SCHEMBL11938839 0.82 MET (0.59) METALDH1A1KDM4E
SCHEMBL1583574 0.81 MET (0.56) METRPS6KA3
SCHEMBL12808129 0.80 MET (0.55) METRPS6KA3ALDH1A1KDM4EMAPT
SCHEMBL1983683 0.78 MET (0.61) METRPS6KA3ALDH1A1KDM4EMAPT
SCHEMBL1993082 0.78 MET (0.62) METRPS6KA3ALDH1A1
SCHEMBL12595668 0.77 MET (0.56) METRPS6KA3ALDH1A1

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-9073939-B2 Indazolyl-substituted dihydroisoxa-zolopyridines and methods of use thereof BAYER INTELLECTUAL PROPERTY GMBH (DE) 2015-07-07 US disclosed
US-9073939-B2 Indazolyl-substituted dihydroisoxa-zolopyridines and methods of use thereof BAYER INTELLECTUAL PROPERTY GMBH (DE) 2015-07-07 US disclosed
EP-2451817-B1 INDAZOLYL-SUBSTITUTED DIHYDROISOXA-ZOLOPYRIDINES AND METHODS OF USE THEREOF BAYER IP GMBH (DE) 2013-09-04 EP disclosed
EP-2451817-B1 INDAZOLYL-SUBSTITUTED DIHYDROISOXA-ZOLOPYRIDINES AND METHODS OF USE THEREOF BAYER IP GMBH (DE) 2013-09-04 EP disclosed
US-20120190709-A1 Indazolyl-substituted dihydroisoxa-zolopyridines and methods of use thereof BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2012-07-26 US disclosed
US-20120190709-A1 Indazolyl-substituted dihydroisoxa-zolopyridines and methods of use thereof BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2012-07-26 US disclosed
EP-2451817-A1 INDAZOLYL-SUBSTITUTED DIHYDROISOXA-ZOLOPYRIDINES AND METHODS OF USE THEREOF Bayer Pharma Aktiengesellschaft (DE) 2012-05-16 EP disclosed
WO-2011003604-A1 INDAZOLYL-SUBSTITUTED DIHYDROISOXA-ZOLOPYRIDINES AND METHODS OF USE THEREOF BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2011-01-13 WO disclosed
WO-2011003604-A1 INDAZOLYL-SUBSTITUTED DIHYDROISOXA-ZOLOPYRIDINES AND METHODS OF USE THEREOF BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2011-01-13 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-20120190709-A1 Indazolyl-substituted dihydroisoxa-zolopyridines and methods of use thereof BMX, MET, ABL1 MET 2/4885RPS6KA3 1483/4885ALDH1A1 2025/4885

“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.