SCHEMBL25794259

SCHEMBL25794259

CCCSc1nc(NCc2ccco2)c2nnn(Cc3ccc(Cl)cc3)c2n1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ USP28 Q96RU2 1/20 0.68
▸ KDM1A O60341 4/20 0.52
▸ MEN1 O00255 4/20 0.46
▸ KMT2A Q03164 4/20 0.46
▸ ALDH1A1 P00352 4/20 0.46
▸ HPGD P15428 2/20 0.46
▸ USP2 O75604 1/20 0.46
▸ POLB P06746 2/20 0.43
▸ GAA P10253 1/20 0.43
▸ PKM P14618 1/20 0.43
▸ ALOX15 P16050 1/20 0.43
▸ TSHR P16473 1/20 0.43
▸ CYP2C9 P11712 2/20 0.42
▸ NPSR1 Q6W5P4 2/20 0.42
▸ CYP1A2 P05177 1/20 0.42
▸ CYP3A4 P08684 1/20 0.42
▸ CYP2D6 P10635 1/20 0.42
▸ CYP2C19 P33261 1/20 0.42
▸ HTT P42858 1/20 0.42
▸ THRB P10828 1/20 0.42

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
SCHEMBL25794195 0.85 USP28 (0.81) USP28KDM1AMEN1KMT2AALDH1A1
SCHEMBL25794224 0.81 USP28 (1.00) USP28KDM1AMEN1KMT2AALDH1A1
SCHEMBL25809849 0.77 USP28 (0.69) USP28KDM1AMEN1KMT2AALDH1A1
SCHEMBL2065766 0.75 P2RY12 (0.53) KDM1AALDH1A1HPGDPOLBCYP2C9
SCHEMBL10074050 0.75 P2RY12 (0.53) KDM1AALDH1A1HPGDPOLBCYP2C9
SCHEMBL5002843 0.75 P2RY12 (0.53) KDM1AALDH1A1HPGDPOLBCYP2C9
SCHEMBL25795474 0.74 USP28 (0.68) USP28KDM1AMEN1KMT2AKDM4E
SCHEMBL25795472 0.74 USP28 (0.83) USP28KDM1AMEN1KMT2AKDM4E
SCHEMBL2065688 0.74 P2RY12 (0.62) ALDH1A1POLBCYP2C9NPSR1CYP1A2
SCHEMBL25794196 0.74 USP28 (0.69) USP28KDM1AMEN1KMT2AALDH1A1

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
WO-2023122298-A1 PROTEIN STABILIZING COMPOUNDS CONTAINING USP28 AND/OR USP25 TARGETING LIGANDS Stablix, Inc. (US) 2023-06-29 — — WO disclosed
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