SCHEMBL11298448

SCHEMBL11298448

COC(=O)c1ccc(C)c(C#Cc2cnc3ccccc3c2)c1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 1/20 0.63
BCR P11274 1/20 0.63
LCK P06239 2/20 0.61
KDR P35968 2/20 0.61
TEK Q02763 2/20 0.61
ALOX15 P16050 1/20 0.50
HTT P42858 1/20 0.50
ALPL P05186 1/20 0.47
ACACB O00763 1/20 0.46
ALDH1A1 P00352 2/20 0.45
KIT P10721 6/20 0.45
DDR1 Q08345 5/20 0.45
CSF1R P07333 3/20 0.45
KDM4E B2RXH2 2/20 0.43
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
MITF O75030 1/20 0.43
XBP1 P17861 1/20 0.43
PAX8 Q06710 1/20 0.43
KLF5 Q13887 1/20 0.43

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
SCHEMBL29722360 0.87 ABL1 (0.64) ABL1BCRLCKKDRTEK
SCHEMBL11298523 0.87 ABL1 (0.64) ABL1BCRLCKKDRTEK
SCHEMBL11297514 0.87 ABL1 (0.64) ABL1BCRLCKKDRTEK
SCHEMBL11297126 0.85 ABL1 (0.68) ABL1BCRLCKKDRTEK
SCHEMBL15363890 0.84 ABL1 (0.75) ABL1BCRLCKKDRTEK
SCHEMBL11297517 0.82 ABL1 (0.58) ABL1BCRLCKKDRTEK
SCHEMBL11298800 0.82 ABL1 (0.75) ABL1BCRLCKKDRTEK
SCHEMBL11297589 0.82 ABL1 (0.87) ABL1BCRLCKKDRTEK
SCHEMBL18274633 0.81 ABL1 (0.76) ABL1BCRLCKKDRTEK
SCHEMBL15363783 0.81 ABL1 (0.77) ABL1BCRLCKKDRTEK

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
EP-2665709-B1 DIARYLACETYLENE HYDRAZIDE CONTAINING TYROSINE KINASE INHIBITORS SUN PHARMA ADVANCED RES CO LTD (IN) 2016-12-07 EP disclosed
EP-2665709-B1 DIARYLACETYLENE HYDRAZIDE CONTAINING TYROSINE KINASE INHIBITORS SUN PHARMA ADVANCED RES CO LTD (IN) 2016-12-07 EP disclosed
US-9024021-B2 Diarylacetylene hydrazide containing tyrosine kinase inhibitors SUN PHARMA ADVANCED RESEARCH COMPANY LTD. (IN) 2015-05-05 US disclosed
US-9024021-B2 Diarylacetylene hydrazide containing tyrosine kinase inhibitors SUN PHARMA ADVANCED RESEARCH COMPANY LTD. (IN) 2015-05-05 US disclosed
US-9024021-B2 Diarylacetylene hydrazide containing tyrosine kinase inhibitors SUN PHARMA ADVANCED RESEARCH COMPANY LTD. (IN) 2015-05-05 US disclosed
EP-2665709-A1 DIARYLACETYLENE HYDRAZIDE CONTAINING TYROSINE KINASE INHIBITORS Sun Pharma Advanced Research Company Limited (IN) 2013-11-27 EP disclosed
US-20130296557-A1 DIARYLACETYLENE HYDRAZIDE CONTAINING TYROSINE KINASE INHIBITORS SUN PHARMA ADVANCED RESEARCH COMPANY LTD. (IN) 2013-11-07 US disclosed
US-20130296557-A1 DIARYLACETYLENE HYDRAZIDE CONTAINING TYROSINE KINASE INHIBITORS SUN PHARMA ADVANCED RESEARCH COMPANY LTD. (IN) 2013-11-07 US disclosed
US-20130296557-A1 DIARYLACETYLENE HYDRAZIDE CONTAINING TYROSINE KINASE INHIBITORS SUN PHARMA ADVANCED RESEARCH COMPANY LTD. (IN) 2013-11-07 US disclosed
WO-2012098416-A1 DIARYLACETYLENE HYDRAZIDE CONTAINING TYROSINE KINASE INHIBITORS SUN PHARMA ADVANCED RESEARCH COMPANY LTD (IN) 2012-07-26 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-20130296557-A1 DIARYLACETYLENE HYDRAZIDE CONTAINING TYROSINE KINASE INHIBITORS ABL1, LCK, JAK2 ABL1 1/4885BCR 130/4885LCK 2/4885

“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.