SCHEMBL17269328

SCHEMBL17269328

O=C(N[C@@H](Cc1cnc[nH]1)C(=O)n1nnc2ccccc21)OCC1c2ccccc2-c2ccccc21

nearest known ligand 0.47

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ MDM4 O15151 3/20 0.47
▸ TP53 P04637 3/20 0.47
▸ MDM2 Q00987 6/20 0.42
▸ P2RY12 Q9H244 1/20 0.38
▸ PRCP P42785 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
SCHEMBL28015870 0.82 MDM4 (0.56) MDM4TP53MDM2
SCHEMBL30600490 0.82 MDM4 (0.56) MDM4TP53MDM2
SCHEMBL17269327 0.82 MDM4 (0.56) MDM4TP53MDM2
SCHEMBL20677239 0.82 MDM4 (0.56) MDM4TP53MDM2
SCHEMBL15164253 0.77 MDM4 (0.48) MDM4TP53MDM2
SCHEMBL27890071 0.77 MDM4 (0.49) MDM4TP53MDM2
SCHEMBL20106639 0.76 MDM4 (0.47) MDM4TP53
SCHEMBL31634371 0.74 MDM2 (0.50) MDM4TP53MDM2PRCP
SCHEMBL38654696 0.73 MGAM (0.47) MDM4TP53
SCHEMBL14614452 0.71 REN (0.41) MDM4TP53

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-20180016301-A1 Synthesis of Beta-Arrestin Effectors FOREST LABORATORIES HOLDINGS LIMITED (BM) 2018-01-18 — — US disclosed
US-9611293-B2 Synthesis of beta-arrestin effectors TREVENA, INC. (US) 2017-04-04 — — US disclosed
US-20150329593-A1 Synthesis of Beta-Arrestin Effectors FOREST LABORATORIES HOLDINGS LIMITED (BM) 2015-11-19 — — 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 (2 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-20180016301-A1 Synthesis of Beta-Arrestin Effectors ARRB1, ADRB1, ADRB3 MDM4 4169/4885TP53 3872/4885MDM2 1072/4885
US-20150329593-A1 Synthesis of Beta-Arrestin Effectors ARRB1, ADRB1, ADRB3 MDM4 4169/4885TP53 3872/4885MDM2 1072/4885

“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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