SCHEMBL13629419

SCHEMBL13629419

CCc1ccc(NS(=O)(=O)c2cc(Cl)cc(Cl)c2)c(C)c1

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.49
RAB9A P51151 1/20 0.49
ACLY P53396 6/20 0.48
METAP2 P50579 2/20 0.48
ALDH1A1 P00352 1/20 0.46
MAPT P10636 2/20 0.44
FFAR4 Q5NUL3 3/20 0.43
TP53 P04637 1/20 0.43
S100A9 P06702 1/20 0.43

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
SCHEMBL13852970 0.89 ALDH1A1 (0.60) NPC1RAB9AMETAP2ALDH1A1MAPT
SCHEMBL13852963 0.88 PKM (0.54) NPC1RAB9AMETAP2ALDH1A1MAPT
SCHEMBL13852947 0.82 NPC1 (0.58) NPC1RAB9AMETAP2ALDH1A1MAPT
SCHEMBL3988400 0.81 METAP2 (0.74) ACLYMETAP2
SCHEMBL13629407 0.80 NHERF1 (0.62) ALDH1A1MAPT
SCHEMBL13853043 0.80 MCL1 (0.50) TP53
SCHEMBL13629412 0.79 ALDH1A1 (0.48) NPC1RAB9AMETAP2ALDH1A1MAPT
SCHEMBL13615239 0.78 HSD17B2 (0.52) ACLYALDH1A1
SCHEMBL13852965 0.78 BRD4 (0.52) METAP2ALDH1A1
SCHEMBL13629459 0.78 FFAR4 (0.71) NPC1RAB9AALDH1A1FFAR4TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090275593-A1 3 Substituted N-(aryl- or heteroaryl)-pyrazolo[1,5-a]pyrimidines as Kinase Inhibitors NOVARTIS AG 2009-11-05 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 (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-20090275593-A1 3 Substituted N-(aryl- or heteroaryl)-pyrazolo[1,5-a]pyrimidines as Kinase Inhibitors TIE1, TEK, MATK NPC1 4249/4885RAB9A 2467/4885ACLY 2202/4885

“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.