SCHEMBL24118285

SCHEMBL24118285

C[C@H](C(=O)Nc1ccc(F)cc1)C12CC(NC(O)c3ccc4cccnc4c3)(C1)C2

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ IDO1 P14902 14/20 0.50
▸ OGA O60502 2/20 0.41
▸ TRPM8 Q7Z2W7 1/20 0.38
▸ LMNA P02545 1/20 0.37
▸ MAPT P10636 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ NOTUM Q6P988 1/20 0.36
▸ AHR P35869 1/20 0.36

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
SCHEMBL24118615 0.83 IDO1 (0.68) IDO1TRPM8
SCHEMBL21496467 0.83 IDO1 (0.68) IDO1TRPM8
SCHEMBL21496468 0.83 IDO1 (0.68) IDO1TRPM8
SCHEMBL21504297 0.80 IDO1 (0.52) IDO1SMN1; SMN2
SCHEMBL23572579 0.74 IDO1 (0.60) IDO1LMNAMAPTSMN1; SMN2
SCHEMBL29639853 0.74 IDO1 (0.60) IDO1LMNAMAPTSMN1; SMN2
SCHEMBL21496393 0.72 IDO1 (0.63) IDO1
SCHEMBL30055593 0.72 IDO1 (0.63) IDO1
SCHEMBL24118309 0.71 IDO1 (0.74) IDO1MAPTSMN1; SMN2
SCHEMBL30055468 0.71 IDO1 (0.74) IDO1MAPTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210393600-A1 Novel [1.1.1] Bicyclo Compounds as Indoleamine 2,3-Dioxygenase Inhibitors MERCK SHARP & DOHME CORP. (US) 2021-12-23 — — 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-20210393600-A1 Novel [1.1.1] Bicyclo Compounds as Indoleamine 2,3-Dioxygenase Inhibitors IDO1, IDO2, TPH1 IDO1 1/4885OGA 1128/4885TRPM8 3099/4885

“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.

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