SCHEMBL30479

SCHEMBL30479

CN(C)CCNc1nc2cc(O)ccc2c2c1C(=O)c1ccccc1-2

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TOP1 P11387 1/20 1.00
CSNK2A1 P68400 3/20 0.49
MALT1 Q9UDY8 1/20 0.43
BRCA1 P38398 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
HIF1A Q16665 1/20 0.43
TOP2A P11388 5/20 0.43
CSNK2A2 P19784 1/20 0.41
CSNK2B P67870 1/20 0.41
ACP1 P24666 2/20 0.40
EHMT2 Q96KQ7 1/20 0.40
KAT2B Q92831 1/20 0.40
MAT2A P31153 1/20 0.39
NQO2 P16083 1/20 0.39
GAA P10253 1/20 0.39
ALPG P10696 1/20 0.39
TLR9 Q9NR96 1/20 0.38
NCF1 P14598 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
SCHEMBL29372771 1.00 TOP1 (1.00) TOP1CSNK2A1MALT1BRCA1SMN1; SMN2
Hydrochloric Acid SCHEMBL29914031 0.99 TOP1 (0.98) TOP1CSNK2A1MALT1BRCA1SMN1; SMN2
Hydrochloric Acid SCHEMBL1333536 0.99 TOP1 (0.98) TOP1CSNK2A1MALT1BRCA1SMN1; SMN2
SCHEMBL26843508 0.88 TOP1 (0.78) TOP1CSNK2A1MALT1BRCA1SMN1; SMN2
SCHEMBL5782011 0.88 TOP1 (0.78) TOP1CSNK2A1SMN1; SMN2TOP2ACSNK2A2
SCHEMBL5785230 0.88 TOP1 (0.78) TOP1CSNK2A1BRCA1SMN1; SMN2HIF1A
Hydrochloric Acid SCHEMBL7823442 0.86 TOP1 (0.76) TOP1CSNK2A1MALT1BRCA1SMN1; SMN2
Hydrochloric Acid SCHEMBL7812716 0.86 TOP1 (0.75) TOP1CSNK2A1
SCHEMBL7810923 0.85 TOP1 (0.74) TOP1CSNK2A1MALT1TOP2AEHMT2
SCHEMBL3257092 0.85 TOP1 (0.74) TOP1CSNK2A1BRCA1SMN1; SMN2HIF1A

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

Appears in 2041 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230045112-A1 DISULFIRAM AND OTHER REDOX-RELATED COMPOSITIONS FOR BRAIN TUMORS TEXAS TECH UNIVERSITY SYSTEM 2023-02-09 US claimed
EP-2805945-B1 Amide substituted indazoles as poly(ADP-ribose)polymerase (PARP) inhibitors MSD ITALIA SRL (IT) 2019-04-03 EP claimed
EP-2603222-B1 COMBINATORY CANCER TREATMENT UNIV MONTREAL (CA) 2018-10-17 EP claimed
US-20160346231-A1 Disulfiram Compositions and Treatments for Brain Tumors TEXAS TECH UNIVERSITY SYSTEM 2016-12-01 US claimed
US-20140301976-A1 NOVEL HYDROXAMATES AS THERAPEUTIC AGENTS PHARMACYCLICS, INC. 2014-10-09 US claimed
US-8779171-B2 Hydroxamates as therapeutic agents PHARMACYCLICS, INC. (US) 2014-07-15 US claimed
US-20130209578-A1 Combinatory Cancer Treatment UNIVERSITE DE MONTREAL (CA) 2013-08-15 US claimed
EP-2603222-A1 COMBINATORY CANCER TREATMENT UNIVERSITE DE MONTREAL (CA) 2013-06-19 EP claimed
US-20130142758-A1 NOVEL HYDROXAMATES AS THERAPEUTIC AGENTS PHARMACYCLICS, INC. (US) 2013-06-06 US claimed
WO-2012019284-A1 COMBINATORY CANCER TREATMENT UNIVERSITE DE MONTREAL (CA) 2012-02-16 WO claimed
EP-1121102-B1 LIPOSOME-ENTRAPPED TOPOISOMERASE INHIBITORS ALZA CORP (US) 2003-04-23 EP claimed
US-20260132164-A1 PNU ANTHRACYCLINE DERIVATIVES AND METHODS OF USE THEREOF MERCK SHARP & DOHME LLC (US) 2026-05-14 US disclosed
EP-4076459-B1 PRMT5 INHIBITORS MERCK SHARP & DOHME LLC (US) 2026-04-29 EP disclosed
US-12595262-B2 PRMT5 inhibitors MERCK SHARP & DOHME LLC (US) 2026-04-07 US disclosed
US-12595248-B2 PRMT5 inhibitors MERCK SHARP & DOHME LLC (US) 2026-04-07 US disclosed
WO-2001017995-A1 TYROSINE KINASE INHIBITORS MERCK & CO., INC. (US) 2001-03-15 WO disclosed
US-6028079-A FOR TREATING TUMOR OF MAMMAL TAIHO PHARMACEUTICAL CO., LTD (JP) 2000-02-22 US disclosed
US-5733918-A ANTITUMOR AGENT TAIHO PHARMACEUTICAL CO., LTD. (JP) 1998-03-31 US disclosed
US-5710162-A ANTITUMOR AGENTS TAIHO PHARMACEUTICAL CO., LTD. (JP) 1998-01-20 US disclosed
EP-0713870-A1 NOVEL FUSED INDAN DERIVATIVE AND PHARMACEUTICALLY ACCEPTABLE SALT THEREOF TAIHO PHARMACEUTICAL CO., LTD. (JP) 1996-05-29 EP disclosed