SCHEMBL16285385

SCHEMBL16285385

CCc1ccc2c(c1)S(=O)(=O)N(C)C(=O)N2

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTK2 Q05397 3/20 0.44
MAP4K4 O95819 1/20 0.44
CHEK2 O96017 1/20 0.44
FYN P06241 1/20 0.44
YES1 P07947 1/20 0.44
FGR P09769 1/20 0.44
KIT P10721 1/20 0.44
MAP3K9 P80192 1/20 0.44
MAP2K1 Q02750 1/20 0.44
MAP4K2 Q12851 1/20 0.44
PTK2B Q14289 1/20 0.44
MYLK Q15746 1/20 0.44
AURKB Q96GD4 1/20 0.44
HSD17B10 Q99714 1/20 0.43
GAA P10253 2/20 0.42
SMN1; SMN2 Q16637 4/20 0.40
ALDH1A1 P00352 5/20 0.38
HPGD P15428 3/20 0.38
KDM4E B2RXH2 2/20 0.38
MAOA P21397 1/20 0.37

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
SCHEMBL8344573 0.79 CA2 (0.54) HSD17B10GAAALDH1A1HPGDKDM4E
SCHEMBL375941 0.78 CA2 (0.53) PTK2GAAL3MBTL1CA2CA9
SCHEMBL7952457 0.78 CA12 (0.53) PTK2MAP4K4HSD17B10SMN1; SMN2ALDH1A1
SCHEMBL16278118 0.78 CA2 (0.53) GAACA2CA9MEN1KMT2A
SCHEMBL4501749 0.73 CA12 (0.64) HSD17B10SMN1; SMN2PARP1CA2CA9
SCHEMBL6490773 0.73 GAA (0.61) GAAKDM4EMAPTCA2CA9
SCHEMBL16278731 0.69 GAA (0.39) GAACA2CA9MEN1KMT2A
SCHEMBL38652383 0.67 LMNA (0.53) PTK2MAP4K4CHEK2FYNYES1
SCHEMBL22010623 0.67 MAOA (0.44) PTK2MAP4K4SMN1; SMN2ALDH1A1KDM4E
SCHEMBL27102376 0.67 BRD4 (0.62)

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-9249163-B2 PDE10a inhibitors for the treatment of type II diabetes JANSSEN PHARMACEUTICA NV. (BE) 2016-02-02 US disclosed
US-20140364414-A1 PDE 10a Inhibitors for the Treatment of Type II Diabetes JANSSEN PHARMACEUTICA, NV (BE) 2014-12-11 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-20140364414-A1 PDE 10a Inhibitors for the Treatment of Type II Diabetes PDE2A, PDE3B, PDE3A PTK2 2345/4885MAP4K4 1586/4885CHEK2 1232/4885

“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.