SCHEMBL20547249

SCHEMBL20547249

CC(C)(C)OC(=O)N1CCc2c(-c3cccc(F)c3)nn(C(=O)OC(C)(C)C)c2CC1

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
RORC P51449 3/20 0.50
KCNK3 O14649 8/20 0.46
HPGDS O60760 2/20 0.46
GRM5 P41594 1/20 0.44
GRM1 Q13255 1/20 0.44
MKNK1 Q9BUB5 1/20 0.43
BRD4 O60885 1/20 0.41
CREBBP Q92793 1/20 0.41
MAP2K4 P45985 1/20 0.41
CSNK1D P48730 1/20 0.40
CSNK1E P49674 1/20 0.40
F12 P00748 1/20 0.40

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
SCHEMBL20547216 0.89 RORC (0.47) RORCGRM5MKNK1BRD4CREBBP
SCHEMBL20547213 0.88 RORC (0.50) RORCKCNK3GRM5MKNK1BRD4
SCHEMBL20547247 0.87 CKS1B (0.51) RORCHPGDSGRM5GRM1CREBBP
SCHEMBL20547291 0.82 GPR119 (0.45) RORCKCNK3GRM5F12
SCHEMBL20547144 0.81 RORC (0.55) RORCGRM5GRM1BRD4CREBBP
SCHEMBL24417770 0.78 P2RX7 (0.52) RORCCREBBP
SCHEMBL20547193 0.78 RORC (0.48) RORCGRM5GRM1F12
SCHEMBL20547294 0.77 RORC (0.55) RORC
SCHEMBL26645904 0.73 CSNK1E (0.55) CSNK1DCSNK1E
SCHEMBL16711190 0.73 CSNK1E (0.55) CSNK1DCSNK1E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3560927-B1 AZEPINE DERIVATIVES ACTING AS 5-HT7 RECEPTOR MODULATORS KOREA INST SCI & TECH (KR) 2023-04-19 EP disclosed
EP-3560927-A1 AZEPINE DERIVATIVE ACTING AS 5-HT7 RECEPTOR MODULATOR Korea Institute of Science and Technology (KR) 2019-10-30 EP disclosed
US-10435408-B2 Azepine derivatives as 5-HT7 receptor modulators KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2019-10-08 US disclosed
US-20180312509-A1 AZEPINE DERIVATIVES AS 5-HT7 RECEPTOR MODULATORS KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2018-11-01 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-20180312509-A1 AZEPINE DERIVATIVES AS 5-HT7 RECEPTOR MODULATORS HTR7, HTR5A, HTR3A RORC 1569/4885KCNK3 1203/4885HPGDS 1649/4885
US-10435408-B2 Azepine derivatives as 5-HT7 receptor modulators HTR7, HTR5A, HTR3A RORC 1569/4885KCNK3 1203/4885HPGDS 1649/4885

“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.