SCHEMBL21246072

SCHEMBL21246072

CC(C)(C)OC(=O)Nc1cccn(C2CCC2)c1=O

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 3/20 0.45
OPRD1 P41143 3/20 0.45
OGFRL1 Q5TC84 3/20 0.45
KMT2A Q03164 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
ELANE P08246 2/20 0.42
IRAK4 Q9NWZ3 1/20 0.40
TYK2 P29597 2/20 0.39
METAP1 P53582 1/20 0.38
OPRK1 P41145 2/20 0.38
CTSL P07711 1/20 0.37
GPR139 Q6DWJ6 1/20 0.37
LMNA P02545 1/20 0.37
NPSR1 Q6W5P4 1/20 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
SCHEMBL20689441 0.96 OPRM1 (0.49) OPRM1OPRD1OGFRL1KMT2AL3MBTL1
SCHEMBL21227592 0.91 TYK2 (0.43) OPRM1OPRD1OGFRL1KMT2AL3MBTL1
SCHEMBL20697315 0.91 TYK2 (0.43) OPRM1OPRD1OGFRL1KMT2AL3MBTL1
SCHEMBL25069957 0.91 TYK2 (0.43) OPRM1OPRD1OGFRL1KMT2AL3MBTL1
SCHEMBL27357534 0.89 TYK2 (0.40) OPRM1OPRD1OGFRL1ELANEIRAK4
SCHEMBL20696938 0.89 TYK2 (0.47) OPRM1OPRD1OGFRL1KMT2AL3MBTL1
SCHEMBL20697448 0.89 TYK2 (0.47) OPRM1OPRD1OGFRL1KMT2AL3MBTL1
SCHEMBL20688549 0.89 TYK2 (0.47) OPRM1OPRD1OGFRL1KMT2AL3MBTL1
SCHEMBL20689579 0.89 TYK2 (0.47) OPRM1OPRD1OGFRL1KMT2AL3MBTL1
SCHEMBL20689512 0.88 TYK2 (0.42) OPRM1OPRD1OGFRL1ELANEIRAK4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10562906-B2 TYK2 inhibitors and uses thereof Nimbus Lakshimi, Inc. (US) 2020-02-18 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 (2 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-10562906-B2 TYK2 inhibitors and uses thereof TYK2, JAK2, JAK1 OPRM1 4673/4885OPRD1 4645/4885OGFRL1 3591/4885
US-20190241576-A1 TYK2 INHIBITORS AND USES THEREOF TYK2, JAK2, JAK1 OPRM1 4673/4885OPRD1 4645/4885OGFRL1 3591/4885

“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.