SCHEMBL30474661

SCHEMBL30474661

CS(=N)(=O)c1ccc(C(=O)Nc2cc(-c3ccc(F)cc3)ccc2N)cn1

nearest known ligand 0.60

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ HDAC2 Q92769 13/20 0.60
▸ HDAC3 O15379 10/20 0.60
▸ HDAC1 Q13547 7/20 0.59
▸ KCNH2 Q12809 3/20 0.51
▸ LMNA P02545 1/20 0.49
▸ POLB P06746 1/20 0.49

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
SCHEMBL25254794 1.00 HDAC2 (0.60) HDAC2HDAC3HDAC1KCNH2LMNA
SCHEMBL31109029 0.92 HDAC1 (0.61) HDAC2HDAC3HDAC1KCNH2LMNA
SCHEMBL30474797 0.86 HDAC2 (0.56) HDAC2HDAC3HDAC1KCNH2
SCHEMBL25262233 0.86 HDAC2 (0.56) HDAC2HDAC3HDAC1KCNH2
SCHEMBL25223188 0.85 HDAC1 (0.59) HDAC2HDAC3HDAC1KCNH2
SCHEMBL25267658 0.85 HDAC1 (0.54) HDAC2HDAC3HDAC1KCNH2LMNA
SCHEMBL30474709 0.85 HDAC1 (0.59) HDAC2HDAC3HDAC1KCNH2
SCHEMBL30474820 0.85 HDAC1 (0.54) HDAC2HDAC3HDAC1KCNH2LMNA
SCHEMBL25258301 0.85 HDAC1 (0.56) HDAC2HDAC3HDAC1KCNH2
SCHEMBL30474736 0.85 HDAC1 (0.56) HDAC2HDAC3HDAC1KCNH2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4441033-A1 NOVEL HDAC INHIBITORS AND THERAPEUTIC USE THEREOF Tango Therapeutics, Inc. (US) 2024-10-09 — — EP disclosed
WO-2023102162-A1 TGONOVEL HDAC INHIBITORS AND THERAPEUTIC USE THEREOF TANGO THERAPEUTICS, INC. (US) 2023-06-08 — — WO disclosed
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