SCHEMBL10043701

SCHEMBL10043701

Cc1cc2c(cn1)cc(-c1cc(NC(=O)C3CCCCC3)ccc1C)c(=O)n2C

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.56
ALDH1A1 P00352 2/20 0.56
HPGD P15428 2/20 0.56
HSD17B10 Q99714 2/20 0.56
ABL1 P00519 10/20 0.52
NPC1 O15118 1/20 0.45
MAPK14 Q16539 1/20 0.45
CNR1 P21554 1/20 0.44
CNR2 P34972 1/20 0.44

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
SCHEMBL10043738 1.00 KDM4E (0.56) KDM4EALDH1A1HPGDHSD17B10ABL1
SCHEMBL10043963 0.95 ABL1 (0.53) KDM4EALDH1A1HPGDHSD17B10ABL1
SCHEMBL10043862 0.93 KDM4E (0.48) KDM4EALDH1A1HPGDHSD17B10ABL1
SCHEMBL10043968 0.91 ABL1 (0.48) KDM4EALDH1A1HPGDHSD17B10ABL1
SCHEMBL854802 0.90 RAB9A (0.55) KDM4EALDH1A1HPGDHSD17B10ABL1
SCHEMBL10043966 0.90 ABL1 (0.47) KDM4EALDH1A1HPGDHSD17B10ABL1
SCHEMBL10043867 0.90 ABL1 (0.47) KDM4EALDH1A1HPGDHSD17B10ABL1
SCHEMBL10043964 0.89 ABL1 (0.47) KDM4EALDH1A1HPGDHSD17B10ABL1
SCHEMBL10043832 0.88 NPC1 (0.52) KDM4EALDH1A1HPGDHSD17B10NPC1
SCHEMBL10043871 0.88 ABL1 (0.46) KDM4EALDH1A1HPGDHSD17B10ABL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8106068-B2 Compositions and methods for modulating c-kit and PDGFR receptors IRM LLC (BM) 2012-01-31 US disclosed
US-8106068-B2 Compositions and methods for modulating c-kit and PDGFR receptors IRM LLC (BM) 2012-01-31 US disclosed
US-20100081656-A1 COMPOSITIONS AND METHODS FOR MODULATING C-KIT AND PDGFR RECEPTORS IRM LLC (BM) 2010-04-01 US disclosed
US-7678792-B2 Compositions and methods for modulating c-kit and PDGFR receptors IRM LLC (BM) 2010-03-16 US disclosed
US-7678792-B2 Compositions and methods for modulating c-kit and PDGFR receptors IRM LLC (BM) 2010-03-16 US disclosed
US-20080176846-A1 COMPOSITIONS AND METHODS FOR MODULATING C-KIT AND PDGFR RECEPTORS IRM LLC (BM) 2008-07-24 US 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 (2 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-20080176846-A1 COMPOSITIONS AND METHODS FOR MODULATING C-KIT AND PDGFR RECEPTORS FYN, FLT3, SRC KDM4E 1572/4885ALDH1A1 4274/4885HPGD 4653/4885
US-20100081656-A1 COMPOSITIONS AND METHODS FOR MODULATING C-KIT AND PDGFR RECEPTORS FYN, FLT3, SRC KDM4E 1572/4885ALDH1A1 4274/4885HPGD 4653/4885

“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.