SCHEMBL4480909

SCHEMBL4480909

CCc1c(I)[nH]c(C=O)c1C(=O)OC

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 1/20 0.46
ALDH1A1 P00352 5/20 0.41
KMT2A Q03164 3/20 0.41
POLB P06746 2/20 0.41
RAB9A P51151 3/20 0.40
LMNA P02545 2/20 0.38
NPSR1 Q6W5P4 2/20 0.35
NPC1 O15118 1/20 0.35
SMN1; SMN2 Q16637 2/20 0.34
L3MBTL1 Q9Y468 1/20 0.33
HPGD P15428 1/20 0.33
MAPK1 P28482 1/20 0.33
MAPT P10636 2/20 0.33
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
NR4A2 P43354 1/20 0.33
BRD4 O60885 1/20 0.32
BRPF1 P55201 1/20 0.32
EP300 Q09472 1/20 0.32
CREBBP Q92793 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
SCHEMBL13919311 0.82 BRD4 (0.41) IGF1RALDH1A1KMT2APOLBRAB9A
SCHEMBL4756903 0.82 IGF1R (0.40) IGF1RALDH1A1KMT2APOLBSMN1; SMN2
SCHEMBL4495786 0.82 LMNA (0.42) ALDH1A1KMT2APOLBRAB9ALMNA
SCHEMBL13933186 0.80 IGF1R (0.51) IGF1RALDH1A1KMT2APOLBRAB9A
SCHEMBL4498917 0.80 IGF1R (0.54) IGF1RALDH1A1KMT2APOLBRAB9A
SCHEMBL13933181 0.79 IGF1R (0.47) IGF1RALDH1A1KMT2APOLBRAB9A
SCHEMBL13933182 0.79 IGF1R (0.50) IGF1RALDH1A1KMT2APOLBRAB9A
SCHEMBL25261258 0.78 ALDH1A1 (0.52) IGF1RALDH1A1KMT2APOLBRAB9A
SCHEMBL4491006 0.77 ALDH1A1 (0.56) IGF1RALDH1A1KMT2ARAB9ALMNA
SCHEMBL4492326 0.77 RAB9A (0.51) IGF1RALDH1A1KMT2APOLBRAB9A

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 12 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
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 102/4885ALDH1A1 2755/4885KMT2A 1302/4885

“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.