SCHEMBL4756903

SCHEMBL4756903

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

nearest known ligand 0.45

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 1/20 0.40
ALDH1A1 P00352 2/20 0.37
POLB P06746 1/20 0.37
KMT2A Q03164 1/20 0.37
BRD4 O60885 1/20 0.31
BRPF1 P55201 1/20 0.31
EP300 Q09472 1/20 0.31
CREBBP Q92793 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.30

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 0.86 BRD4 (0.41) IGF1RALDH1A1POLBKMT2ABRD4
SCHEMBL13919314 0.85 IGF1R (0.36) IGF1RALDH1A1POLBKMT2A
SCHEMBL4480909 0.82 IGF1R (0.46) IGF1RALDH1A1POLBKMT2ABRD4
SCHEMBL4480914 0.76 LDHA (0.33) ALDH1A1POLBKMT2A
SCHEMBL4492326 0.75 RAB9A (0.51) IGF1RALDH1A1POLBKMT2ASMN1; SMN2
SCHEMBL4499054 0.72 IGF1R (0.35) IGF1RALDH1A1POLBKMT2A
SCHEMBL13919312 0.71 IGF1R (0.48) IGF1RALDH1A1POLBKMT2ABRD4
SCHEMBL4208158 0.71 IGF1R (0.76) IGF1RALDH1A1POLBKMT2ABRD4
SCHEMBL4480832 0.71 IGF1R (0.34) IGF1RALDH1A1POLBKMT2A
SCHEMBL4505680 0.70 IGF1R (0.34) IGF1RALDH1A1POLBKMT2A

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 4 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 disclosed
EP-1651599-A4 TYROSINE KINASE INHIBITORS MERCK & CO INC (US) 2008-09-24 EP 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