SCHEMBL6156436

SCHEMBL6156436

Cc1ccc(Nc2nnc(-c3cccc(OC(F)(F)F)c3)s2)cc1Cl

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GUSB P08236 2/20 0.49
PIM1 P11309 1/20 0.48
PIM3 Q86V86 1/20 0.48
MEN1 O00255 3/20 0.45
KMT2A Q03164 3/20 0.45
POLB P06746 2/20 0.45
CTDSP1 Q9GZU7 1/20 0.45
CHRNA7 P36544 2/20 0.44
DHODH Q02127 4/20 0.43
KIT P10721 1/20 0.41
RAB9A P51151 1/20 0.41
ROCK1 Q13464 2/20 0.40
ROCK2 O75116 1/20 0.40
KDM4E B2RXH2 2/20 0.40
ALDH1A1 P00352 2/20 0.40
CCNC P24863 1/20 0.40
CDK8 P49336 1/20 0.40
MAPT P10636 1/20 0.40
POLQ O75417 1/20 0.39
USP2 O75604 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
SCHEMBL6690137 0.82 GUSB (0.48) GUSBMEN1KMT2APOLBCTDSP1
SCHEMBL6684447 0.82 GUSB (0.48) GUSBMEN1KMT2APOLBCTDSP1
SCHEMBL6154386 0.81 GUSB (0.51) GUSBPIM1PIM3MEN1KMT2A
SCHEMBL6153546 0.81 GUSB (0.49) GUSBMEN1KMT2APOLBCTDSP1
SCHEMBL6155706 0.78 GUSB (0.72) GUSBMEN1KMT2APOLBCTDSP1
SCHEMBL6154871 0.77 GUSB (0.61) GUSBPIM1PIM3MEN1KMT2A
SCHEMBL6153748 0.76 GUSB (0.54) GUSBPIM1PIM3MEN1KMT2A
SCHEMBL6154575 0.75 GUSB (0.61) GUSBMEN1KMT2APOLBCTDSP1
SCHEMBL6154359 0.75 GUSB (0.65) GUSBMEN1KMT2APOLBCTDSP1
SCHEMBL6155606 0.75 GUSB (0.61) GUSBPIM1PIM3MEN1KMT2A

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-20050065118-A1 Organosulfur inhibitors of tyrosine phosphatases METABASIS THERAPEUTICS, INC. 2005-03-24 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 (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-20050065118-A1 Organosulfur inhibitors of tyrosine phosphatases PTPRS, PTPRJ, PTPRCAP GUSB 2466/4885PIM1 658/4885PIM3 787/4885

“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.