SCHEMBL544152

SCHEMBL544152

COCCNC(=O)Nc1nc2ccc(OS(=O)(=O)c3c(C)cccc3Cl)cc2s1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GHSR Q92847 3/20 0.53
LCK P06239 7/20 0.52
SMN1; SMN2 Q16637 3/20 0.51
MAPT P10636 3/20 0.51
PKM P14618 1/20 0.51
GSK3A P49840 1/20 0.51
GSK3B P49841 1/20 0.51
MET P08581 1/20 0.51
CDK9 P50750 1/20 0.51
ALDH1A1 P00352 1/20 0.48
POLB P06746 1/20 0.48
CSNK1D P48730 1/20 0.47
CASP2 P42575 1/20 0.46
FYN P06241 1/20 0.46
SRC P12931 1/20 0.46
KDM4E B2RXH2 1/20 0.45
NPC1 O15118 1/20 0.45
RAB9A P51151 1/20 0.45
ABL1 P00519 1/20 0.44
PIK3CG P48736 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
SCHEMBL544665 0.95 GHSR (0.58) GHSRLCKSMN1; SMN2MAPTPKM
SCHEMBL544153 0.86 MET (0.67) GHSRSMN1; SMN2MAPTPKMGSK3A
SCHEMBL544180 0.84 ABL1 (0.56) LCKSMN1; SMN2MAPTMETALDH1A1
SCHEMBL544191 0.83 LCK (0.60) LCKSMN1; SMN2MAPTPOLBNPC1
SCHEMBL544868 0.82 PIK3CA (0.57) GHSRLCKSMN1; SMN2MAPTPKM
SCHEMBL544638 0.81 GHSR (0.60) GHSRSMN1; SMN2MAPTPKMGSK3A
SCHEMBL544856 0.81 TUBB4A (0.64) GHSRSMN1; SMN2MAPTPKMGSK3A
SCHEMBL544204 0.80 ABL1 (0.58) GHSRSMN1; SMN2MAPTPKMGSK3A
SCHEMBL544033 0.80 GHSR (0.52) GHSRLCKSMN1; SMN2MAPTPKM
SCHEMBL543778 0.80 MET (0.66) GSK3BMETCDK9ABL1PIK3CG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8110571-B2 Tyrosine kinase inhibitors; antiproliferation agents; metabolism diseases; antiallergens; central nervous system disorders; vision and skin disorders; antiarthritic agents AVENTIS PHARMA S.A. (FR) 2012-02-07 US disclosed
US-20080194555-A1 Novel Benzimidazole and Benzothiazole Derivatives, Method for Preparing Same, Use Thereof as Drugs, Pharmaceutical Compositions and Novel Use Especially as c-MET Inhibitors AVENTIS PHARMA S.A. (FR) 2008-08-14 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-20080194555-A1 Novel Benzimidazole and Benzothiazole Derivatives, Method for Preparing Same, Use Thereof as Drugs, Pharmaceutical Compositions and Novel Use Especially as c-MET Inhibitors MET, KIT, MERTK GHSR 1821/4885LCK 503/4885SMN1; SMN2 4373/4885

“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.