SCHEMBL20092262

SCHEMBL20092262

CS(=O)(=O)c1cc(C2CC2)ccc1N

nearest known ligand 0.39

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 2/20 0.39
HDAC2 Q92769 2/20 0.39
HDAC3 O15379 1/20 0.39
TYK2 P29597 10/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
G6PD P11413 1/20 0.36
IDE P14735 1/20 0.36
DRD2 P14416 2/20 0.35
SIGMAR1 Q99720 1/20 0.35
WDR5 P61964 1/20 0.35
SYK P43405 1/20 0.34
QDPR P09417 2/20 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
SCHEMBL20093001 0.93 TYK2 (0.38) HDAC1HDAC2HDAC3TYK2L3MBTL1
SCHEMBL20092137 0.89 TYK2 (0.41) TYK2
SCHEMBL2112353 0.89 QDPR (0.49) SIGMAR1QDPR
Hydrochloric Acid SCHEMBL4435866 0.88 QDPR (0.47) SIGMAR1QDPR
SCHEMBL25289702 0.83 HDAC1 (0.36) HDAC1HDAC2HDAC3TYK2WDR5
SCHEMBL20092461 0.83 TYK2 (0.43) TYK2
SCHEMBL14454641 0.82 HDAC1 (0.42) HDAC1HDAC2HDAC3WDR5QDPR
SCHEMBL30490281 0.81 HDAC1 (0.40) HDAC1HDAC2HDAC3TYK2L3MBTL1
SCHEMBL20093169 0.81 TYK2 (0.44) TYK2
SCHEMBL20092390 0.81 TYK2 (0.44) TYK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210094948-A1 TYK2 INHIBITORS AND USES THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2021-04-01 US disclosed
US-10647713-B2 TYK2 inhibitors and uses thereof NIMBUS LAKSHMI, INC. (US) 2020-05-12 US disclosed
US-20180134700-A1 TYK2 INHIBITORS AND USES THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2018-05-17 US disclosed
US-20180134700-A1 TYK2 INHIBITORS AND USES THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2018-05-17 US disclosed
WO-2018075937-A1 TYK2 INHIBITORS AND USES THEREOF NIMBUS LAKSHMI, INC. (US) 2018-04-26 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 (3 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-20210094948-A1 TYK2 INHIBITORS AND USES THEREOF TYK2, JAK2, JAK1 HDAC1 2265/4885HDAC2 926/4885HDAC3 1711/4885
US-20180134700-A1 TYK2 INHIBITORS AND USES THEREOF TYK2, JAK2, JAK1 HDAC1 2265/4885HDAC2 926/4885HDAC3 1711/4885
US-10647713-B2 TYK2 inhibitors and uses thereof TYK2, JAK2, JAK1 HDAC1 2265/4885HDAC2 926/4885HDAC3 1711/4885

“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.