SCHEMBL24110482

SCHEMBL24110482

CN(C)CC(=O)n1ccc2cccc(F)c21

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
FABP4 P15090 1/20 0.39
OXER1 Q8TDS5 1/20 0.38
NOTUM Q6P988 1/20 0.38
PARP1 P09874 1/20 0.35
SLC6A2 P23975 1/20 0.34
SLC6A4 P31645 1/20 0.34
DNMT1 P26358 1/20 0.33
APOBEC3A P31941 1/20 0.33
APOBEC3G Q9HC16 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
AR P10275 1/20 0.33
HTR2C P28335 1/20 0.33
KDM4E B2RXH2 1/20 0.33
TDP1 Q9NUW8 2/20 0.33
CNR1 P21554 1/20 0.32
CNR2 P34972 1/20 0.32
CCR2 P41597 1/20 0.32

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
SCHEMBL24110585 0.80 FABP4 (0.43) FABP4OXER1NOTUML3MBTL1KDM4E
SCHEMBL30705807 0.76 FABP4 (0.45) FABP4OXER1NOTUMPARP1L3MBTL1
SCHEMBL24110356 0.75 FABP4 (0.38) FABP4OXER1NOTUMPARP1SLC6A2
SCHEMBL24110378 0.75 FABP4 (0.38) FABP4OXER1NOTUMPARP1SLC6A2
SCHEMBL24110494 0.75 FABP4 (0.38) FABP4OXER1NOTUMPARP1SLC6A2
SCHEMBL24109952 0.75 NOTUM (0.64) NOTUML3MBTL1HTR2CKDM4E
SCHEMBL24110347 0.75 HTR2A (0.50) OXER1NOTUMHTR2CKDM4E
SCHEMBL24110479 0.71 HTR2C (0.41) FABP4OXER1NOTUMSLC6A2SLC6A4
SCHEMBL24110331 0.71 TFPI2 (0.44) FABP4OXER1NOTUMSLC6A2SLC6A4
SCHEMBL16339898 0.71 ACLY (0.54) FABP4NOTUML3MBTL1AR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230219969-A1 ISOTRYPTAMINE PSYCHOPLASTOGENS AND USES THEREOF DELIX THERAPEUTICS, INC. 2023-07-13 US disclosed
US-20230219969-A1 ISOTRYPTAMINE PSYCHOPLASTOGENS AND USES THEREOF DELIX THERAPEUTICS, INC. 2023-07-13 US disclosed
WO-2021252692-A1 ISOTRYPTAMINE PSYCHOPLASTOGENS AND USES THEREOF DELIX THERAPEUTICS, INC. (US) 2021-12-16 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-20230219969-A1 ISOTRYPTAMINE PSYCHOPLASTOGENS AND USES THEREOF GAP43, SLC18A2, PNMT FABP4 752/4885OXER1 1435/4885NOTUM 795/4885

“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.