SCHEMBL19404632

SCHEMBL19404632

Cc1cc2c(cc1N1C(=O)c3cccc4c(CCCO)ccc(c34)C1=O)n(C)c(=O)n2C

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ BRD1 O95696 19/20 1.00
▸ BRPF1 P55201 19/20 1.00
▸ TAF1 P21675 19/20 1.00
▸ TAF1L Q8IZX4 1/20 1.00
▸ CREBBP Q92793 1/20 1.00
▸ CECR2 Q9BXF3 1/20 1.00
▸ BRPF3 Q9ULD4 1/20 1.00
▸ BRD4 O60885 3/20 0.62

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
SCHEMBL29430386 1.00 BRD1 (1.00) BRD1BRPF1TAF1TAF1LCREBBP
SCHEMBL30737021 1.00 BRD1 (1.00) BRD1BRPF1TAF1TAF1LCREBBP
SCHEMBL19404614 0.97 BRD1 (1.00) BRD1BRPF1TAF1TAF1LCREBBP
SCHEMBL19405044 0.89 BRD1 (0.82) BRD1BRPF1TAF1TAF1LCREBBP
SCHEMBL19404615 0.88 TAF1 (0.79) BRD1BRPF1TAF1TAF1LCREBBP
SCHEMBL19404631 0.88 BRD1 (0.79) BRD1BRPF1TAF1TAF1LCREBBP
SCHEMBL19405054 0.86 BRD1 (0.75) BRD1BRPF1TAF1TAF1LCREBBP
SCHEMBL19404849 0.86 BRD1 (0.75) BRD1BRPF1TAF1TAF1LCREBBP
SCHEMBL23318540 0.85 BRD1 (0.75) BRD1BRPF1TAF1TAF1LCREBBP
SCHEMBL19404629 0.85 TAF1 (0.75) BRD1BRPF1TAF1TAF1LCREBBP

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-20190192502-A1 Modulation of Transcription Initiation Factor TFIID Subunit 1 (TAF1) for Treating Leukemia UNIVERSITY OF MIAMI 2019-06-27 — — US claimed
US-20190192502-A1 Modulation of Transcription Initiation Factor TFIID Subunit 1 (TAF1) for Treating Leukemia UNIVERSITY OF MIAMI 2019-06-27 — — US disclosed
WO-2017162661-A1 1H-BENZO[DE]ISOQUINOLINE-1,3(2H)-DIONES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2017-09-28 — — WO disclosed
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