SCHEMBL10043946

SCHEMBL10043946

Cc1cc2c(cn1)cc(-c1cc(C(=O)NC(=O)Nc3cc(C)on3)ccc1C)c(=O)n2C

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.50
RAB9A P51151 6/20 0.47
NPC1 O15118 4/20 0.47
SMN1; SMN2 Q16637 2/20 0.44
MAPK14 Q16539 5/20 0.42
MAPK13 O15264 1/20 0.39
RAF1 P04049 1/20 0.39
PDGFRA P16234 1/20 0.39
MAPKAPK2 P49137 1/20 0.39
MAPK12 P53778 1/20 0.39
KCNH2 Q12809 1/20 0.39
MAPK11 Q15759 1/20 0.39

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
SCHEMBL10043897 0.93 ALDH1A1 (0.59) ALDH1A1RAB9ANPC1SMN1; SMN2MAPK14
SCHEMBL10043938 0.89 MAPK14 (0.55) ALDH1A1RAB9AMAPK14MAPK13RAF1
SCHEMBL10043944 0.87 SRC (0.41) ALDH1A1RAB9ANPC1SMN1; SMN2MAPK14
SCHEMBL10043928 0.86 RAB9A (0.45) ALDH1A1RAB9ANPC1SMN1; SMN2MAPK14
SCHEMBL10043936 0.86 NPC1 (0.48) ALDH1A1RAB9ANPC1SMN1; SMN2MAPK14
SCHEMBL10043948 0.85 MAPK14 (0.42) RAB9ANPC1MAPK14MAPK13RAF1
SCHEMBL10043933 0.85 RAB9A (0.46) ALDH1A1RAB9ANPC1SMN1; SMN2MAPK14
SCHEMBL501911 0.85 SYK (0.46) RAB9ANPC1MAPK14MAPK13RAF1
SCHEMBL10043932 0.85 MAPK14 (0.43) ALDH1A1RAB9ANPC1MAPK14MAPK13
SCHEMBL10043870 0.84 RAB9A (0.40) ALDH1A1RAB9ANPC1SMN1; SMN2MAPK14

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-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-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 ALDH1A1 4274/4885RAB9A 1818/4885NPC1 4095/4885
US-20100081656-A1 COMPOSITIONS AND METHODS FOR MODULATING C-KIT AND PDGFR RECEPTORS FYN, FLT3, SRC ALDH1A1 4274/4885RAB9A 1818/4885NPC1 4095/4885

“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.