SCHEMBL20697218

SCHEMBL20697218

COc1cnc(-n2cccc(NC(C)C)c2=O)c(F)c1

nearest known ligand 0.37

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 1/20 0.37
ADORA1 P30542 1/20 0.37
TYK2 P29597 8/20 0.36
MAPK8 P45983 1/20 0.35
MAPK14 Q16539 1/20 0.35
IDH1 O75874 2/20 0.34
GRM1 Q13255 1/20 0.34
IRAK4 Q9NWZ3 1/20 0.33
MET P08581 1/20 0.33
GAA P10253 1/20 0.33
SYK P43405 1/20 0.33
TDP1 Q9NUW8 2/20 0.33
TDP2 O95551 1/20 0.33
GPR6 P46095 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
SCHEMBL20687663 0.87 GRM1 (0.41) TYK2GRM1
SCHEMBL21246070 0.80 NPC1 (0.41) GAA
SCHEMBL20689187 0.80 ROCK2 (0.35) ADORA2AGRM1MET
SCHEMBL20689489 0.79 ELANE (0.38) TYK2GAASYK
SCHEMBL20687662 0.79 TYK2 (0.45) TYK2IRAK4
SCHEMBL20687688 0.78 TYK2 (0.48) TYK2
SCHEMBL20689490 0.78 GABRG2 (0.41) TYK2MET
SCHEMBL20689491 0.77 TYK2 (0.41) TYK2METTDP1
SCHEMBL20688184 0.72 TYK2 (0.33) TYK2MAPK8MAPK14
SCHEMBL21227347 0.70 PTGS1 (0.41) TYK2GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230056447-A1 TYK2 INHIBITORS AND USES THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2023-02-23 US disclosed
US-11174264-B2 TYK2 inhibitors and uses thereof NIMBUS LAKSHMI, INC. (US) 2021-11-16 US disclosed
US-11046698-B2 TYK2 inhibitors and uses thereof NIMBUS LAKSHMI, INC. (US) 2021-06-29 US disclosed
US-20200231594-A1 TYK2 INHIBITORS AND USES THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2020-07-23 US disclosed
US-10577373-B2 TYK2 inhibitors and uses thereof Nimbus Lakshimi, Inc. (US) 2020-03-03 US disclosed
US-10562906-B2 TYK2 inhibitors and uses thereof Nimbus Lakshimi, Inc. (US) 2020-02-18 US disclosed
US-10562907-B2 TYK2 inhibitors and uses thereof Nimbus Lakshimi, Inc. (US) 2020-02-18 US disclosed
US-20190256519-A1 TYK2 INHIBITORS AND USES THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2019-08-22 US disclosed
US-20190248797-A1 TYK2 INHIBITORS AND USES THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2019-08-15 US disclosed
US-20190241576-A1 TYK2 INHIBITORS AND USES THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2019-08-08 US disclosed
US-20190031664-A1 TYK2 INHIBITORS AND USES THEREOF TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2019-01-31 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 (11 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-11174264-B2 TYK2 inhibitors and uses thereof TYK2, JAK2, JAK1 ADORA2A 4694/4885ADORA1 4815/4885TYK2 1/4885
US-20190248797-A1 TYK2 INHIBITORS AND USES THEREOF TYK2, JAK2, JAK1 ADORA2A 4694/4885ADORA1 4815/4885TYK2 1/4885
US-11046698-B2 TYK2 inhibitors and uses thereof TYK2, JAK2, JAK1 ADORA2A 4694/4885ADORA1 4815/4885TYK2 1/4885
US-20190256519-A1 TYK2 INHIBITORS AND USES THEREOF TYK2, JAK2, JAK1 ADORA2A 4694/4885ADORA1 4815/4885TYK2 1/4885
US-20190031664-A1 TYK2 INHIBITORS AND USES THEREOF TYK2, JAK2, JAK1 ADORA2A 4694/4885ADORA1 4815/4885TYK2 1/4885
US-10562906-B2 TYK2 inhibitors and uses thereof TYK2, JAK2, JAK1 ADORA2A 4694/4885ADORA1 4815/4885TYK2 1/4885
US-20190241576-A1 TYK2 INHIBITORS AND USES THEREOF TYK2, JAK2, JAK1 ADORA2A 4694/4885ADORA1 4815/4885TYK2 1/4885
US-20230056447-A1 TYK2 INHIBITORS AND USES THEREOF TYK2, JAK2, JAK1 ADORA2A 4694/4885ADORA1 4815/4885TYK2 1/4885
US-20200231594-A1 TYK2 INHIBITORS AND USES THEREOF TYK2, JAK2, JAK1 ADORA2A 4694/4885ADORA1 4815/4885TYK2 1/4885
US-10577373-B2 TYK2 inhibitors and uses thereof TYK2, JAK2, JAK1 ADORA2A 4694/4885ADORA1 4815/4885TYK2 1/4885
US-10562907-B2 TYK2 inhibitors and uses thereof TYK2, JAK2, JAK1 ADORA2A 4694/4885ADORA1 4815/4885TYK2 1/4885

“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.