SCHEMBL29923158

SCHEMBL29923158

Cc1ccc(-c2cccc3c2OCC[C@H]3CN(C)C(=O)OC(C)(C)C)cn1

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 3/20 0.34
AAK1 Q2M2I8 1/20 0.33
BRD4 O60885 1/20 0.33
CREBBP Q92793 1/20 0.33
HSD17B10 Q99714 1/20 0.32
SPR P35270 1/20 0.32
KDM4C Q9H3R0 4/20 0.32
P2RX7 Q99572 4/20 0.32
RET P07949 1/20 0.32
HTR2A P28223 1/20 0.31
HTR2C P28335 1/20 0.31
SLC6A4 P31645 1/20 0.31
DGAT1 O75907 1/20 0.31
SCN5A Q14524 1/20 0.31
CNR2 P34972 1/20 0.31

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
SCHEMBL29923604 0.92 KCNH2 (0.34) SCN9AAAK1BRD4CREBBPSPR
SCHEMBL29923492 0.89 CPT2 (0.34) SCN9ABRD4CREBBPKDM4CHTR2A
SCHEMBL27214562 0.89 CPT2 (0.34) SCN9ABRD4CREBBPKDM4CHTR2A
SCHEMBL29923339 0.88 GPR119 (0.37) SCN9AHSD17B10KDM4CSCN5A
SCHEMBL29923145 0.88 GPR119 (0.37) SCN9AHSD17B10KDM4CSCN5A
SCHEMBL29923128 0.88 BRD4 (0.33) AAK1BRD4CREBBPKDM4CHTR2C
SCHEMBL29923626 0.88 HTR2C (0.33) SPRKDM4CP2RX7HTR2AHTR2C
SCHEMBL29923610 0.88 BRD4 (0.33) AAK1BRD4CREBBPKDM4CHTR2C
SCHEMBL29923313 0.87 GPR119 (0.33) SCN9ABRD4CREBBPSPRKDM4C
SCHEMBL27214569 0.87 KDM4C (0.38) SCN9AHSD17B10KDM4CP2RX7

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 SCN9A 1896/4885AAK1 1049/4885BRD4 931/4885

“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.