SCHEMBL21246029

SCHEMBL21246029

O=C(O)c1cccn(C2CCOCC2)c1=O

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 2/20 0.39
PARP1 P09874 1/20 0.39
CNR1 P21554 1/20 0.39
KDM4E B2RXH2 1/20 0.38
POLB P06746 1/20 0.38
TYK2 P29597 10/20 0.38
GAA P10253 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36

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
SCHEMBL20594635 0.89 KDM4E (0.42) KDM4EPOLBTYK2GAA
SCHEMBL20689625 0.89 TYK2 (0.48) CNR2PARP1CNR1KDM4EPOLB
SCHEMBL22498188 0.86 KDM4E (0.47) CNR2PARP1CNR1KDM4EPOLB
SCHEMBL31186116 0.84 TYK2 (0.37) CNR2CNR1KDM4EPOLBTYK2
SCHEMBL30612395 0.84 KDM4E (0.52) CNR2PARP1CNR1KDM4EPOLB
Hydrochloric Acid SCHEMBL11452778 0.83 KDM4E (0.51) CNR2PARP1CNR1KDM4EPOLB
SCHEMBL20697469 0.83 TYK2 (0.42) TYK2
SCHEMBL20688004 0.83 ALDH1A1 (0.42) CNR2CNR1KDM4ETYK2SMN1; SMN2
SCHEMBL20689365 0.82 PARP1 (0.44) PARP1KDM4EPOLBGAASMN1; SMN2
SCHEMBL29754548 0.82 DHODH (0.38) CNR2CNR1KDM4ETYK2GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024035950-A1 INHIBITORS OF KIF18A AND USES THEREOF ACCENT THERAPEUTICS, INC. (US) 2024-02-15 WO disclosed
WO-2024035950-A1 INHIBITORS OF KIF18A AND USES THEREOF ACCENT THERAPEUTICS, INC. (US) 2024-02-15 WO 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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (6 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-20190248797-A1 TYK2 INHIBITORS AND USES THEREOF TYK2, JAK2, JAK1 CNR2 3535/4885PARP1 939/4885CNR1 4281/4885
US-20190256519-A1 TYK2 INHIBITORS AND USES THEREOF TYK2, JAK2, JAK1 CNR2 3535/4885PARP1 939/4885CNR1 4281/4885
US-10562906-B2 TYK2 inhibitors and uses thereof TYK2, JAK2, JAK1 CNR2 3535/4885PARP1 939/4885CNR1 4281/4885
US-20190241576-A1 TYK2 INHIBITORS AND USES THEREOF TYK2, JAK2, JAK1 CNR2 3535/4885PARP1 939/4885CNR1 4281/4885
US-10577373-B2 TYK2 inhibitors and uses thereof TYK2, JAK2, JAK1 CNR2 3535/4885PARP1 939/4885CNR1 4281/4885
US-10562907-B2 TYK2 inhibitors and uses thereof TYK2, JAK2, JAK1 CNR2 3535/4885PARP1 939/4885CNR1 4281/4885

“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.