SCHEMBL6086913

SCHEMBL6086913

O=C(CCc1cccnc1)Nc1cccc(-c2n[nH]cc2-c2nc3ccccc3o2)c1

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 10/20 0.53
KDM4E B2RXH2 9/20 0.53
POLB P06746 4/20 0.53
SMN1; SMN2 Q16637 4/20 0.53
P2RY14 Q15391 9/20 0.49
ALDH1A1 P00352 7/20 0.49
HPGD P15428 6/20 0.49
USP2 O75604 5/20 0.49
ESR1 P03372 1/20 0.49
RAB9A P51151 3/20 0.49
NPC1 O15118 2/20 0.49
MEN1 O00255 1/20 0.49
MAPT P10636 1/20 0.49
KMT2A Q03164 1/20 0.49
NPSR1 Q6W5P4 1/20 0.49
TSHR P16473 2/20 0.48
MAPK1 P28482 2/20 0.48
GAA P10253 1/20 0.48
GLA P06280 1/20 0.47

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
SCHEMBL6083887 0.83 CETP (0.55) HSD17B10KDM4EPOLBSMN1; SMN2ALDH1A1
SCHEMBL6084643 0.82 KDM4E (0.60) HSD17B10KDM4EPOLBP2RY14ALDH1A1
SCHEMBL6084978 0.81 P2RY14 (0.61) HSD17B10KDM4EPOLBP2RY14ALDH1A1
SCHEMBL6085606 0.80 MEN1 (0.55) HSD17B10KDM4EPOLBSMN1; SMN2P2RY14
SCHEMBL6085757 0.79 NAMPT (0.55) HSD17B10KDM4EPOLBP2RY14ALDH1A1
SCHEMBL6085378 0.79 HSD17B10 (0.57) HSD17B10KDM4EPOLBSMN1; SMN2P2RY14
SCHEMBL6084151 0.78 MAPT (0.61) HSD17B10KDM4EPOLBSMN1; SMN2ALDH1A1
SCHEMBL6086289 0.78 P2RY14 (0.62) HSD17B10KDM4EPOLBP2RY14ALDH1A1
SCHEMBL6086892 0.77 USP2 (0.74) HSD17B10KDM4EPOLBP2RY14ALDH1A1
SCHEMBL6083942 0.76 P2RY14 (0.54) HSD17B10KDM4EPOLBP2RY14ALDH1A1

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-7105535-B2 Oxazolyl-pyrazole derivatives as kinase inhibitors PFIZER ITALIA S.R.L. (IT) 2006-09-12 US claimed
EP-1377589-B1 OXAZOLYL-PYRAZOLE DERIVATIVES AS KINASE INHIBITORS PHARMACIA ITALIA SPA (IT) 2005-09-07 EP claimed
US-20040180881-A1 Oxazolyl-pyrazole derivatives as kinase inhibitors PFIZER ITALIA S.R.L. (IT) 2004-09-16 US claimed
US-7105535-B2 Oxazolyl-pyrazole derivatives as kinase inhibitors PFIZER ITALIA S.R.L. (IT) 2006-09-12 US disclosed
EP-1377589-B1 OXAZOLYL-PYRAZOLE DERIVATIVES AS KINASE INHIBITORS PHARMACIA ITALIA SPA (IT) 2005-09-07 EP disclosed
US-20040180881-A1 Oxazolyl-pyrazole derivatives as kinase inhibitors PFIZER ITALIA S.R.L. (IT) 2004-09-16 US disclosed
EP-1377589-A1 OXAZOLYL-PYRAZOLE DERIVATIVES AS KINASE INHIBITORS Pharmacia Italia S.p.A. (IT) 2004-01-07 EP disclosed
WO-2002062804-A1 OXAZOLYL-PYRAZOLE DERIVATIVES AS KINASE INHIBITORS PHARMACIA ITALIA S.P.A. (IT) 2002-08-15 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-20040180881-A1 Oxazolyl-pyrazole derivatives as kinase inhibitors MAP3K15, MAP3K20, MAP3K3 HSD17B10 3948/4885KDM4E 1175/4885POLB 1679/4885

“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.