SCHEMBL25846333

SCHEMBL25846333

CC(C)(C)OC(=O)N1CCc2[nH]c3ncc(Cl)cc3c2CC1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
BAZ2B Q9UIF8 2/20 0.42
KIT P10721 2/20 0.42
MKNK1 Q9BUB5 3/20 0.40
POLB P06746 1/20 0.39
CNR1 P21554 2/20 0.39
STS P08842 2/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
ESR2 Q92731 1/20 0.39
MAPT P10636 1/20 0.39
TSHR P16473 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
CDK9 P50750 1/20 0.39
F12 P00748 2/20 0.38
MAPK1 P28482 1/20 0.38

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
SCHEMBL30339675 1.00 BAZ2B (0.42) BAZ2BKITMKNK1POLBCNR1
SCHEMBL404753 0.93 BAZ2B (0.48) BAZ2BMKNK1MEN1KMT2AESR2
SCHEMBL31424848 0.83 ESR2 (0.40) BAZ2BKITMKNK1POLBCNR1
SCHEMBL30339672 0.80 KIT (0.48) KITPOLBMAPTCDK9
SCHEMBL6482914 0.80 CGAS (0.59) BAZ2BCNR1STSMEN1KMT2A
SCHEMBL24101723 0.80 KIT (0.48) KITPOLBMAPTCDK9
SCHEMBL6483420 0.80 BAZ2B (0.45) BAZ2BCNR1MEN1KMT2AESR2
SCHEMBL21588363 0.80 CDK9 (0.44) KITMKNK1ESR2MAPTCDK9
SCHEMBL30667649 0.79 MAPT (0.46) BAZ2BMKNK1ESR2MAPT
SCHEMBL24101581 0.77 KDM4E (0.38) BAZ2BMEN1KMT2A

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-20230227453-A1 TRICYCLIC PSYCHOPLASTOGENS AND USES THEREOF DELIX THERAPEUTICS, INC. 2023-07-20 US disclosed
US-20230227453-A1 TRICYCLIC PSYCHOPLASTOGENS AND USES THEREOF DELIX THERAPEUTICS, INC. 2023-07-20 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 (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-20230227453-A1 TRICYCLIC PSYCHOPLASTOGENS AND USES THEREOF GAP43, GRIN2A, GRIN2C BAZ2B 3141/4885KIT 2589/4885MKNK1 1007/4885

“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.