SCHEMBL3501245

SCHEMBL3501245

Cc1cc(C)c(S(=O)(=O)NCc2cccnc2)cc1Nc1cc2ccc(F)cc2c2c(Cl)nccc12

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.52
ALDH1A1 P00352 5/20 0.48
TSHR P16473 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.43
HTT P42858 1/20 0.43
PKM P14618 3/20 0.41
KMT2A Q03164 3/20 0.41
KDM4E B2RXH2 1/20 0.41
MEN1 O00255 1/20 0.41
CYP2C19 P33261 1/20 0.39
PDK1 Q15118 1/20 0.39
PDK2 Q15119 1/20 0.39
PDK3 Q15120 1/20 0.39
PDK4 Q16654 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
SCHEMBL13225045 0.88 POLB (0.51) POLBALDH1A1TSHRSMN1; SMN2HTT
SCHEMBL2863284 0.74 POLB (0.51) POLBALDH1A1TSHRSMN1; SMN2HTT
SCHEMBL2861973 0.72 POLB (0.49) POLBALDH1A1TSHRSMN1; SMN2HTT
SCHEMBL3501205 0.69 P2RX7 (0.31) POLB
SCHEMBL3502653 0.68 KDR (0.35) KMT2A
SCHEMBL3501861 0.67 POLB (0.81) POLBALDH1A1TSHRSMN1; SMN2HTT
SCHEMBL17208549 0.66 ALDH1A1 (1.00) POLBALDH1A1TSHRSMN1; SMN2HTT
SCHEMBL16589868 0.65 CYP2C19 (0.69) POLBALDH1A1TSHRSMN1; SMN2HTT
SCHEMBL4730919 0.65 POLB (0.58) POLBALDH1A1TSHRSMN1; SMN2HTT
SCHEMBL7011026 0.63 TSHR (0.74) POLBALDH1A1TSHRSMN1; SMN2HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8349865-B2 Inhibitors of janus kinases MERCK SHARP & DOHME CORP. (US) 2013-01-08 US disclosed
EP-2200612-B1 INHIBITORS OF JANUS KINASES SCHERING CORP (US) 2012-08-08 EP disclosed
US-20100197634-A1 INHIBITORS OF JANUS KINASES MERCK SHARP & DOHME LLC 2010-08-05 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-20100197634-A1 INHIBITORS OF JANUS KINASES JAK2, JAK3, JAK1 POLB 3002/4885ALDH1A1 3244/4885TSHR 1368/4885

“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.