SCHEMBL22012448

SCHEMBL22012448

CC(C)N(C)c1ccc(S(=O)(=O)Cl)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.43
HSD17B10 Q99714 2/20 0.43
TDP1 Q9NUW8 2/20 0.43
KDM4E B2RXH2 2/20 0.41
ALOX15 P16050 2/20 0.41
HPGD P15428 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
CA2 P00918 6/20 0.39
CA1 P00915 5/20 0.39
CA12 O43570 4/20 0.39
MAPT P10636 2/20 0.38
MCOLN3 Q8TDD5 1/20 0.38
CA9 Q16790 5/20 0.34
CA4 P22748 2/20 0.34
CA5A P35218 2/20 0.34
CA7 P43166 2/20 0.34
CA5B Q9Y2D0 2/20 0.34
CA3 P07451 1/20 0.34
CA6 P23280 1/20 0.34
CA13 Q8N1Q1 1/20 0.34

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
SCHEMBL9727546 0.81 ALDH1A1 (0.44) ALDH1A1HSD17B10TDP1KDM4EALOX15
SCHEMBL295564 0.80 ALDH1A1 (0.61) ALDH1A1HSD17B10TDP1KDM4EALOX15
SCHEMBL25033772 0.79 CA2 (0.64) ALDH1A1TDP1CA2CA1CA12
SCHEMBL14256498 0.79 LMNA (0.46) ALDH1A1HSD17B10TDP1KDM4EALOX15
SCHEMBL3066016 0.75 MAPT (0.47) ALDH1A1HSD17B10TDP1KDM4EALOX15
SCHEMBL651902 0.74 ALDH1A1 (0.71) ALDH1A1HSD17B10TDP1CA2CA1
SCHEMBL7834724 0.73 ALDH1A1 (0.58) ALDH1A1HSD17B10TDP1KDM4EALOX15
SCHEMBL5301480 0.73 ALDH1A1 (0.47) ALDH1A1HSD17B10TDP1KDM4EALOX15
SCHEMBL15148197 0.72 ALDH1A1 (0.61) ALDH1A1HSD17B10TDP1KDM4EALOX15
SCHEMBL9727341 0.72 EGFR (0.42) ALDH1A1HSD17B10TDP1HPGDSMN1; SMN2

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-20230051589-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NOVARTIS AG (CH) 2023-02-16 US disclosed
WO-2020102576-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NOVARTIS INFLAMMASOME RESEARCH, INC. (US) 2020-05-22 WO 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-20230051589-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY NLRP1, NLRP3, NOD1 ALDH1A1 1999/4885HSD17B10 1041/4885TDP1 1361/4885

“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.