SCHEMBL29923313

SCHEMBL29923313

CN(C[C@@H]1CCOc2c(-c3cncnc3)cccc21)C(=O)OC(C)(C)C

nearest known ligand 0.33

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 1/20 0.33
KCNH2 Q12809 1/20 0.32
SCN5A Q14524 1/20 0.32
SCN9A Q15858 1/20 0.32
BRD4 O60885 1/20 0.32
CREBBP Q92793 1/20 0.32
KDM4C Q9H3R0 8/20 0.32
IDO1 P14902 4/20 0.32
SPR P35270 1/20 0.31
HTR2C P28335 1/20 0.31
SLC6A4 P31645 1/20 0.31
MAOA P21397 1/20 0.30
CNR2 P34972 1/20 0.30

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
SCHEMBL29923145 0.92 GPR119 (0.37) GPR119SCN5ASCN9AKDM4C
SCHEMBL29923339 0.92 GPR119 (0.37) GPR119SCN5ASCN9AKDM4C
SCHEMBL29923604 0.90 KCNH2 (0.34) KCNH2SCN5ASCN9ABRD4CREBBP
SCHEMBL27214554 0.90 BRD4 (0.34) GPR119BRD4CREBBPKDM4CHTR2C
SCHEMBL27214590 0.90 BRD4 (0.34) GPR119BRD4CREBBPKDM4CHTR2C
SCHEMBL27231219 0.90 BRD4 (0.34) GPR119BRD4CREBBPKDM4CHTR2C
SCHEMBL29923582 0.88 GPR119 (0.35) GPR119BRD4CREBBPKDM4CSPR
SCHEMBL29923252 0.87 GPR119 (0.38) GPR119
SCHEMBL27214548 0.87 GPR119 (0.38) GPR119
SCHEMBL29923158 0.87 SCN9A (0.34) SCN5ASCN9ABRD4CREBBPKDM4C

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-20240150330-A1 CHROMANS AND BENZOFURANS AS 5-HT1A AND TAAR1 AGONISTS SUNOVION PHARMACEUTICALS INC. (US) 2024-05-09 US disclosed
WO-2022217232-A1 CHROMANS AND BENZOFURANS AS 5-HT1A AND TAAR1 AGONISTS SUNOVION PHARMACEUTICALS INC. (US) 2022-10-13 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 (1 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-20240150330-A1 CHROMANS AND BENZOFURANS AS 5-HT1A AND TAAR1 AGONISTS TAAR1, HTR1A, HTR1F GPR119 234/4885KCNH2 1424/4885SCN5A 1425/4885

“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.