SCHEMBL29923626

SCHEMBL29923626

Cc1cc(-c2cccc3c2OCC[C@H]3CN(C)C(=O)OC(C)(C)C)c(C)cn1

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 4/20 0.33
SLC6A4 P31645 4/20 0.33
CNR2 P34972 1/20 0.32
ABL1 P00519 1/20 0.32
PTGDR2 Q9Y5Y4 1/20 0.31
SPR P35270 1/20 0.31
PDK2 Q15119 1/20 0.31
KDM4C Q9H3R0 2/20 0.31
HTR2A P28223 1/20 0.31
P2RX7 Q99572 2/20 0.31
FFAR1 O14842 2/20 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
SCHEMBL29923158 0.88 SCN9A (0.34) HTR2CSLC6A4CNR2SPRKDM4C
SCHEMBL27214597 0.87 KDM4C (0.36) ABL1PTGDR2KDM4C
SCHEMBL27231322 0.87 KDM4C (0.36) ABL1PTGDR2KDM4C
SCHEMBL27214539 0.87 KDM4C (0.36) KDM4C
SCHEMBL29923235 0.87 KDM4C (0.36) KDM4C
SCHEMBL29923128 0.86 BRD4 (0.33) HTR2CSLC6A4CNR2KDM4C
SCHEMBL29923610 0.86 BRD4 (0.33) HTR2CSLC6A4CNR2KDM4C
SCHEMBL29923104 0.85 P2RX7 (0.35) HTR2CSLC6A4CNR2PTGDR2KDM4C
SCHEMBL29923604 0.85 KCNH2 (0.34) HTR2CSLC6A4CNR2SPRPDK2
SCHEMBL27231342 0.85 P2RX7 (0.35) HTR2CSLC6A4CNR2PTGDR2KDM4C

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 HTR2C 14/4885SLC6A4 95/4885CNR2 119/4885

“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.