SCHEMBL27195694

SCHEMBL27195694

CN1CCC(c2ccc(C(=O)Nc3ccc(F)c4nccnc34)cc2)CC1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HDAC1 Q13547 4/20 0.59
▸ HDAC3 O15379 4/20 0.59
▸ HDAC2 Q92769 3/20 0.59
▸ HDAC8 Q9BY41 3/20 0.59
▸ HDAC4 P56524 2/20 0.59
▸ HDAC7 Q8WUI4 2/20 0.59
▸ HDAC10 Q969S8 2/20 0.59
▸ HDAC11 Q96DB2 2/20 0.59
▸ HDAC6 Q9UBN7 2/20 0.59
▸ HDAC9 Q9UKV0 2/20 0.59
▸ HDAC5 Q9UQL6 2/20 0.59
▸ KDM1A O60341 2/20 0.50
▸ MAOA P21397 2/20 0.50
▸ KDM1B Q8NB78 2/20 0.50
▸ RCOR1 Q9UKL0 2/20 0.50
▸ HTR1F P30939 12/20 0.49
▸ HTR1A P08908 4/20 0.46
▸ HTR1D P28221 4/20 0.46
▸ HTR1B P28222 4/20 0.46
▸ HTR2A P28223 1/20 0.46

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
SCHEMBL30863481 1.00 HDAC1 (0.59) HDAC1HDAC3HDAC2HDAC8HDAC4
SCHEMBL27195780 0.88 HDAC1 (0.58) HDAC1HDAC3HDAC2HDAC8HDAC4
SCHEMBL27195730 0.88 HDAC1 (0.58) HDAC1HDAC3HDAC2HDAC8HDAC4
SCHEMBL27195724 0.83 HDAC1 (0.62) HDAC1HDAC3HDAC2HDAC8HDAC4
SCHEMBL30863440 0.82 HDAC3 (0.62) HDAC3HDAC8
SCHEMBL27195699 0.82 HDAC3 (0.62) HDAC3HDAC8
SCHEMBL27195718 0.81 HDAC1 (0.57) HDAC1HDAC3HDAC2HDAC8HDAC4
SCHEMBL27195743 0.80 HDAC6 (0.62) HDAC1HDAC3HDAC2HDAC8HDAC4
SCHEMBL27195717 0.80 HDAC1 (0.56) HDAC1HDAC3HDAC2HDAC8HDAC4
SCHEMBL27195716 0.77 HDAC1 (0.55) HDAC1HDAC3HDAC2HDAC8HDAC4

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-4353712-A1 NEW N-HETEROARYLBENZAMIDES DERIVATIVES AS FLT3 INHIBITORS Biodol Therapeutics (FR) 2024-04-17 — — EP claimed
EP-4353712-A1 NEW N-HETEROARYLBENZAMIDES DERIVATIVES AS FLT3 INHIBITORS Biodol Therapeutics (FR) 2024-04-17 — — EP disclosed
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