SCHEMBL29678995

SCHEMBL29678995

O=C(N[C@@H](Cc1ccc2ccccc2n1)C(=O)O)OCC1c2ccccc2-c2ccccc21

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ MDM4 O15151 3/20 0.53
▸ TP53 P04637 3/20 0.53
▸ MDM2 Q00987 6/20 0.47
▸ CASP3 P42574 2/20 0.46
▸ SLC17A5 Q9NRA2 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ TLR2 O60603 1/20 0.43

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
SCHEMBL6507462 1.00 MDM4 (0.53) MDM4TP53MDM2CASP3SLC17A5
SCHEMBL6507453 1.00 MDM4 (0.53) MDM4TP53MDM2CASP3SLC17A5
SCHEMBL4532629 0.87 MDM4 (0.52) MDM4TP53MDM2CASP3SLC17A5
SCHEMBL31370327 0.84 MDM4 (0.52) MDM4TP53MDM2CASP3SLC17A5
SCHEMBL21639100 0.83 MDM4 (0.53) MDM4TP53MDM2CASP3SLC17A5
SCHEMBL21639103 0.83 MDM4 (0.53) MDM4TP53MDM2CASP3SLC17A5
SCHEMBL31694964 0.82 MDM4 (0.56) MDM4TP53MDM2CASP3SLC17A5
SCHEMBL29907962 0.82 MDM4 (0.56) MDM4TP53MDM2CASP3SLC17A5
SCHEMBL30069011 0.82 MDM4 (0.56) MDM4TP53MDM2CASP3SLC17A5
SCHEMBL3725839 0.82 MDM4 (0.56) MDM4TP53MDM2CASP3SLC17A5

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
EP-4003959-A1 TARGETED RADIOPHARMACEUTICALS FOR THE DIAGNOSIS AND TREATMENT OF PROSTATE CANCER Bayer AS (NO) 2022-06-01 — — EP disclosed
Send feedback