SCHEMBL20073548

SCHEMBL20073548

CN(c1cc(C2CCC2)ccc1N)S(C)(=O)=O

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 4/20 0.39
TYK2 P29597 6/20 0.39
HDAC1 Q13547 4/20 0.35
HDAC2 Q92769 4/20 0.35
HDAC3 O15379 1/20 0.35
ALK Q9UM73 2/20 0.33
BACE1 P56817 1/20 0.33
NPM1 P06748 1/20 0.33
PER2 O15055 1/20 0.33
CRY1 Q16526 1/20 0.33
CRY2 Q49AN0 1/20 0.33

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
SCHEMBL20150204 0.96 CYP19A1 (0.43) CYP19A1TYK2HDAC1HDAC2BACE1
SCHEMBL29686281 0.94 TYK2 (0.42) CYP19A1TYK2HDAC1HDAC2HDAC3
SCHEMBL20093009 0.94 TYK2 (0.42) CYP19A1TYK2HDAC1HDAC2HDAC3
SCHEMBL20150174 0.87 TYK2 (0.46) CYP19A1TYK2ALK
SCHEMBL20073547 0.86 TYK2 (0.48) CYP19A1TYK2
SCHEMBL20230844 0.84 GAA (0.40) CYP19A1TYK2
SCHEMBL20155672 0.81 TYK2 (0.36) CYP19A1TYK2PER2CRY1CRY2
SCHEMBL20073679 0.80 TYK2 (0.36) CYP19A1TYK2PER2CRY1CRY2
SCHEMBL24498549 0.79 CYP2C9 (0.35) TYK2HDAC1HDAC2HDAC3
SCHEMBL29686947 0.79 HDAC1 (0.35) TYK2HDAC1HDAC2HDAC3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220073527-A1 TYK2 INHIBITORS AND USES THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2022-03-10 US disclosed
US-11220508-B2 TYK2 inhibitors and uses thereof NIMBUS LAKSHMI, INC. (US) 2022-01-11 US disclosed
US-11174265-B2 2021-11-16 US disclosed
US-20210230163-A1 TYK2 INHIBITORS AND USES THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2021-07-29 US disclosed
EP-3848370-A2 TYK2 INHIBITORS AND USES THEREOF Nimbus Lakshmi, Inc. (US) 2021-07-14 EP disclosed
US-10793574-B2 TYK2 inhibitors and uses thereof NIMBUS LAKSHMI, INC. (US) 2020-10-06 US disclosed
US-20190284194-A1 TYK2 INHIBITORS AND USES THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2019-09-19 US disclosed
US-10323036-B2 TYK2 inhibitors and uses thereof NIMBUS LAKSHMI, INC. (US) 2019-06-18 US disclosed
US-20180155349-A1 TYK2 INHIBITORS AND USES THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2018-06-07 US disclosed
US-20180155349-A1 TYK2 INHIBITORS AND USES THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2018-06-07 US disclosed
WO-2018075937-A1 TYK2 INHIBITORS AND USES THEREOF NIMBUS LAKSHMI, INC. (US) 2018-04-26 WO disclosed
WO-2018071794-A1 TYK2 INHIBITORS AND USES THEREOF NIMBUS LAKSHMI, INC. (US) 2018-04-19 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 (8 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-11220508-B2 TYK2 inhibitors and uses thereof TYK2, JAK2, JAK1 CYP19A1 2724/4885TYK2 1/4885HDAC1 2265/4885
US-10793574-B2 TYK2 inhibitors and uses thereof TYK2, JAK2, JAK1 CYP19A1 2724/4885TYK2 1/4885HDAC1 2265/4885
US-10323036-B2 TYK2 inhibitors and uses thereof TYK2, JAK2, JAK1 CYP19A1 2724/4885TYK2 1/4885HDAC1 2265/4885
US-20210230163-A1 TYK2 INHIBITORS AND USES THEREOF TYK2, JAK2, JAK1 CYP19A1 2724/4885TYK2 1/4885HDAC1 2265/4885
US-20190284194-A1 TYK2 INHIBITORS AND USES THEREOF TYK2, JAK2, JAK1 CYP19A1 2724/4885TYK2 1/4885HDAC1 2265/4885
US-11174265-B2 TYK2, JAK2, JAK1 CYP19A1 2529/4885TYK2 1/4885HDAC1 1463/4885
US-20180155349-A1 TYK2 INHIBITORS AND USES THEREOF TYK2, JAK2, JAK1 CYP19A1 2724/4885TYK2 1/4885HDAC1 2265/4885
US-20220073527-A1 TYK2 INHIBITORS AND USES THEREOF TYK2, JAK2, JAK1 CYP19A1 2724/4885TYK2 1/4885HDAC1 2265/4885

“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.