SCHEMBL18802292

SCHEMBL18802292

Cc1cccc(NS(=O)(=O)C2CC2)n1

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.55
KDM4E B2RXH2 5/20 0.55
HPGD P15428 5/20 0.55
HSD17B10 Q99714 3/20 0.55
LMNA P02545 2/20 0.53
L3MBTL1 Q9Y468 1/20 0.51
HSD11B1 P28845 7/20 0.50
SCN9A Q15858 1/20 0.50
GLA P06280 1/20 0.50
MAPT P10636 1/20 0.47
CTPS1 P17812 1/20 0.46
RAB9A P51151 1/20 0.46

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
SCHEMBL16827647 0.80 SCN9A (0.50) SCN9ACTPS1
SCHEMBL29464233 0.80 SCN9A (0.50) SCN9ACTPS1
SCHEMBL24369034 0.80 SCN9A (0.50) SCN9ACTPS1
SCHEMBL29826535 0.80 SCN9A (0.50) SCN9ACTPS1
SCHEMBL18725653 0.80 SCN9A (0.50) SCN9ACTPS1
SCHEMBL12017942 0.77 ALDH1A1 (0.64) ALDH1A1KDM4EHPGDHSD17B10LMNA
SCHEMBL17868449 0.76 KDM4E (0.50) KDM4ELMNASCN9ACTPS1
SCHEMBL24369035 0.76 CTPS1 (0.55) SCN9ACTPS1
SCHEMBL24369036 0.76 CTSK (0.52) HSD11B1SCN9ACTPS1
SCHEMBL17803526 0.74 CTPS1 (0.42) ALDH1A1KDM4EHPGDL3MBTL1HSD11B1

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-9777030-B2 Complexes JOHNSON MATTHEY PUBLIC LIMITED COMPANY (GB) 2017-10-03 US disclosed
US-20170120231-A1 COMPLEXES JOHNSON MATTHEY PUBLIC LIMITED COMPANY (GB) 2017-05-04 US disclosed
US-20170120231-A1 COMPLEXES JOHNSON MATTHEY PUBLIC LIMITED COMPANY (GB) 2017-05-04 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-20170120231-A1 COMPLEXES AP3M1, CYCS, AP1M1 ALDH1A1 1792/4885KDM4E 4105/4885HPGD 1920/4885

“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.