SCHEMBL30248327

SCHEMBL30248327

Cc1noc(C)c1-c1cccc2sc(NC(=O)[C@H]3CCNC3)nc12

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 7/20 0.47
▸ MEN1 O00255 6/20 0.47
▸ RAB9A P51151 4/20 0.47
▸ NPC1 O15118 3/20 0.47
▸ SMN1; SMN2 Q16637 2/20 0.44
▸ TP53 P04637 1/20 0.44
▸ TSHR P16473 1/20 0.44
▸ ADORA2A P29274 1/20 0.43
▸ AHR P35869 1/20 0.42
▸ MAPT P10636 4/20 0.41
▸ HTT P42858 2/20 0.41
▸ KDM4E B2RXH2 2/20 0.40
▸ POLB P06746 2/20 0.40
▸ LMNA P02545 1/20 0.40
▸ CYP1A2 P05177 1/20 0.40
▸ CYP3A4 P08684 1/20 0.40
▸ CYP2C9 P11712 1/20 0.40
▸ CYP2C19 P33261 1/20 0.40
▸ NPSR1 Q6W5P4 1/20 0.40
▸ PSMD14 O00487 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
SCHEMBL30248351 0.86 RAB9A (0.42) KMT2AMEN1RAB9ANPC1SMN1; SMN2
SCHEMBL30718469 0.86 RAB9A (0.42) KMT2AMEN1RAB9ANPC1SMN1; SMN2
SCHEMBL17631569 0.83 NPC1 (0.43) KMT2AMEN1RAB9ANPC1SMN1; SMN2
SCHEMBL17631568 0.83 NPC1 (0.43) KMT2AMEN1RAB9ANPC1SMN1; SMN2
SCHEMBL17632001 0.81 NPC1 (0.42) KMT2AMEN1RAB9ANPC1SMN1; SMN2
SCHEMBL30271964 0.81 NPC1 (0.42) KMT2AMEN1RAB9ANPC1SMN1; SMN2
SCHEMBL17631999 0.81 NPC1 (0.42) KMT2AMEN1RAB9ANPC1SMN1; SMN2
SCHEMBL30718495 0.81 ABL1 (0.45) KMT2AMEN1RAB9ANPC1SMN1; SMN2
SCHEMBL31166705 0.79 UCHL1 (0.49) KMT2AMEN1RAB9ANPC1SMN1; SMN2
SCHEMBL27306151 0.79 UCHL1 (0.49) KMT2AMEN1RAB9ANPC1SMN1; 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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4547247-A2 DEUBIQUITINASE INHIBITORS AND METHODS OF USE THEREOF Dana-Farber Cancer Institute, Inc. (US) 2025-05-07 — — EP disclosed
EP-4377299-A1 SMALL MOLECULE INHIBITION OF DEUBIQUITINATING ENZYME JOSEPHIN DOMAIN CONTAINING 1 (JOSD1) AS A TARGETED THERAPY FOR LEUKEMIAS WITH MUTANT JANUS KINASE 2 (JAK2) Dana-Farber Cancer Institute, Inc. (US) 2024-06-05 — — EP disclosed
WO-2024006956-A9 DEUBIQUITINASE INHIBITORS AND METHODS OF USE THEREOF DANA-FARBER CANCER INSTITUTE, INC. (US) 2024-04-11 — — WO disclosed
WO-2024006956-A2 DEUBIQUITINASE INHIBITORS AND METHODS OF USE THEREOF DANA-FARBER CANCER INSTITUTE, INC. (US) 2024-01-04 — — WO disclosed
WO-2023009982-A1 SMALL MOLECULE INHIBITION OF DEUBIQUITINATING ENZYME JOSEPHIN DOMAIN CONTAINING 1 (JOSD1) AS A TARGETED THERAPY FOR LEUKEMIAS WITH MUTANT JANUS KINASE 2 (JAK2) DANA-FARBER CANCER INSTITUTE, INC. (US) 2023-02-02 — — WO disclosed
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