SCHEMBL20073418

SCHEMBL20073418

CN(c1cc(N2CCC2)ccc1N)S(C)(=O)=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.44
GAA P10253 3/20 0.44
MAPT P10636 3/20 0.44
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
L3MBTL1 Q9Y468 3/20 0.44
S100B P04271 2/20 0.44
MAPK1 P28482 2/20 0.44
HTT P42858 2/20 0.44
ALDH1A1 P00352 2/20 0.44
ALOX15 P16050 2/20 0.44
PKM P14618 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
TYK2 P29597 3/20 0.43
IP6K1 Q92551 2/20 0.43
TSHR P16473 1/20 0.41
KDM4E B2RXH2 1/20 0.39
RECQL P46063 1/20 0.39
PTK2B Q14289 1/20 0.39
HTR6 P50406 2/20 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
SCHEMBL26121387 0.96 MAPT (0.50) LMNAGAAMAPTMEN1KMT2A
SCHEMBL29686404 0.87 LGMN (0.52) LMNAGAAMAPTMEN1KMT2A
SCHEMBL24498537 0.87 LGMN (0.52) LMNAGAAMAPTMEN1KMT2A
SCHEMBL20092297 0.83 TYK2 (0.48) LMNAMAPTKMT2AALDH1A1TYK2
SCHEMBL20073647 0.81 TYK2 (0.41) LMNAMAPTMEN1KMT2AL3MBTL1
SCHEMBL26511011 0.81 MEN1 (0.46) LMNAMAPTMEN1KMT2AL3MBTL1
SCHEMBL20073684 0.80 TYK2 (0.40) LMNAMAPTMEN1KMT2AL3MBTL1
SCHEMBL20073397 0.80 TYK2 (0.48) KMT2ATYK2TSHR
SCHEMBL24498535 0.79 MEN1 (0.48) LMNAGAAMAPTMEN1KMT2A
SCHEMBL24497504 0.78 TSHR (0.40) LMNAGAAMAPTMEN1KMT2A

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 14 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-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-20210094948-A1 TYK2 INHIBITORS AND USES THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2021-04-01 US disclosed
US-10793574-B2 TYK2 inhibitors and uses thereof NIMBUS LAKSHMI, INC. (US) 2020-10-06 US disclosed
US-10647713-B2 TYK2 inhibitors and uses thereof NIMBUS LAKSHMI, INC. (US) 2020-05-12 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
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
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 (9 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 LMNA 2078/4885GAA 1899/4885MAPT 1236/4885
US-10793574-B2 TYK2 inhibitors and uses thereof TYK2, JAK2, JAK1 LMNA 2078/4885GAA 1899/4885MAPT 1236/4885
US-10323036-B2 TYK2 inhibitors and uses thereof TYK2, JAK2, JAK1 LMNA 2078/4885GAA 1899/4885MAPT 1236/4885
US-20210230163-A1 TYK2 INHIBITORS AND USES THEREOF TYK2, JAK2, JAK1 LMNA 2078/4885GAA 1899/4885MAPT 1236/4885
US-20180134700-A1 TYK2 INHIBITORS AND USES THEREOF TYK2, JAK2, JAK1 LMNA 2078/4885GAA 1899/4885MAPT 1236/4885
US-20190284194-A1 TYK2 INHIBITORS AND USES THEREOF TYK2, JAK2, JAK1 LMNA 2078/4885GAA 1899/4885MAPT 1236/4885
US-20180155349-A1 TYK2 INHIBITORS AND USES THEREOF TYK2, JAK2, JAK1 LMNA 2078/4885GAA 1899/4885MAPT 1236/4885
US-10647713-B2 TYK2 inhibitors and uses thereof TYK2, JAK2, JAK1 LMNA 2078/4885GAA 1899/4885MAPT 1236/4885
US-20220073527-A1 TYK2 INHIBITORS AND USES THEREOF TYK2, JAK2, JAK1 LMNA 2078/4885GAA 1899/4885MAPT 1236/4885

“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.