SCHEMBL24118338

SCHEMBL24118338

C=C(CCNC(=O)c1cc(Cl)ccc1F)[C@H](C)C(=O)Nc1ccc(F)cc1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ GCGR P47871 6/20 0.46
▸ P2RX1 P51575 1/20 0.46
▸ GCG P01275 3/20 0.46
▸ EPHX2 P34913 2/20 0.44
▸ KLK7 P49862 1/20 0.43
▸ GRIK1 P39086 1/20 0.41
▸ POLB P06746 2/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ THRB P10828 1/20 0.40
▸ RECQL P46063 1/20 0.40
▸ TDP1 Q9NUW8 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ IDO1 P14902 3/20 0.40
▸ CNR1 P21554 1/20 0.40

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
SCHEMBL24118326 0.93 GCG (0.49) GCGRP2RX1GCGKLK7GRIK1
SCHEMBL24118062 0.83 IDO1 (0.54) GCGRGCGKLK7POLBALDH1A1
SCHEMBL24117949 0.83 IDO1 (0.53) GCGPOLBALDH1A1L3MBTL1IDO1
SCHEMBL24117957 0.82 GCGR (0.46) GCGRGCG
SCHEMBL24118068 0.82 IDO1 (0.55) KLK7POLBALDH1A1L3MBTL1IDO1
SCHEMBL24118064 0.82 IDO1 (0.46) GCGPOLBALDH1A1IDO1
SCHEMBL24118386 0.81 MEN1 (0.42) GCGPOLBALDH1A1L3MBTL1IDO1
SCHEMBL24118272 0.81 MEN1 (0.44) GCGPOLBALDH1A1RECQLIDO1
SCHEMBL24118073 0.81 ALDH1A1 (0.46) GCGPOLBALDH1A1L3MBTL1IDO1
SCHEMBL24118254 0.79 FPR2 (0.48) POLBALDH1A1RECQLCNR1

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 GCGR 3754/4885P2RX1 2238/4885GCG 4675/4885

“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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