SCHEMBL4488833

SCHEMBL4488833

CCc1c(C#CC2(O)CCCC2)[nH]c(C=O)c1C(=O)OC

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 1/20 0.37
KMT2A Q03164 2/20 0.35
MEN1 O00255 1/20 0.35
ALDH1A1 P00352 3/20 0.32
RAB9A P51151 1/20 0.32
POLB P06746 1/20 0.32
L3MBTL1 Q9Y468 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
SCHEMBL4486260 0.99 KMT2A (0.36) IGF1RKMT2AMEN1ALDH1A1RAB9A
SCHEMBL4482893 0.77 IGF1R (0.40) IGF1RKMT2AMEN1ALDH1A1RAB9A
SCHEMBL4491721 0.77 IGF1R (0.45) IGF1RKMT2AMEN1ALDH1A1RAB9A
SCHEMBL13932865 0.77 KMT2A (0.50) IGF1RKMT2AMEN1ALDH1A1RAB9A
SCHEMBL4490389 0.76 IGF1R (0.44) IGF1RKMT2AMEN1ALDH1A1RAB9A
SCHEMBL13933185 0.76 KMT2A (0.52) IGF1RKMT2AMEN1ALDH1A1RAB9A
SCHEMBL4490766 0.75 IGF1R (0.39) IGF1RKMT2AALDH1A1RAB9APOLB
SCHEMBL4493072 0.75 IGF1R (0.39) IGF1RKMT2AALDH1A1RAB9APOLB
SCHEMBL4497334 0.74 IGF1R (0.38) IGF1RKMT2AALDH1A1RAB9APOLB
SCHEMBL4489148 0.74 ALDH1A1 (0.46) IGF1RALDH1A1RAB9AL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7504429-B2 Tyrosine kinase inhibitors MERCK & CO., INC. (US) 2009-03-17 US claimed
EP-1651599-A4 TYROSINE KINASE INHIBITORS MERCK & CO INC (US) 2008-09-24 EP claimed
US-20060189577-A1 Tyrosine kinase inhibitors MERCK SHARP & DOHME CORP. 2006-08-24 US claimed
EP-1651599-A1 TYROSINE KINASE INHIBITORS Merck & Co., Inc. (US) 2006-05-03 EP claimed
WO-2005009957-A1 TYROSINE KINASE INHIBITORS MERCK & CO., INC. (US) 2005-02-03 WO claimed
US-7504429-B2 Tyrosine kinase inhibitors MERCK & CO., INC. (US) 2009-03-17 US disclosed
US-7504429-B2 Tyrosine kinase inhibitors MERCK & CO., INC. (US) 2009-03-17 US disclosed
EP-1651599-A4 TYROSINE KINASE INHIBITORS MERCK & CO INC (US) 2008-09-24 EP disclosed
US-20060189577-A1 Tyrosine kinase inhibitors MERCK SHARP & DOHME CORP. 2006-08-24 US disclosed
EP-1651599-A1 TYROSINE KINASE INHIBITORS Merck & Co., Inc. (US) 2006-05-03 EP disclosed
WO-2005009957-A1 TYROSINE KINASE INHIBITORS MERCK & CO., INC. (US) 2005-02-03 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-20060189577-A1 Tyrosine kinase inhibitors ABL1, RET, ERBB2 IGF1R 102/4885KMT2A 1302/4885MEN1 2744/4885

“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.