SCHEMBL9284694

SCHEMBL9284694

CC(C)(C)c1ccc(NC(=O)c2ccc(C(=O)Nc3ccc(C(C)(C)C)cc3)c3ccccc23)cc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CFTR P13569 1/20 0.63
▸ DHPS P49366 1/20 0.62
▸ HDAC3 O15379 1/20 0.57
▸ HDAC11 Q96DB2 1/20 0.57
▸ HDAC8 Q9BY41 1/20 0.57
▸ HDAC6 Q9UBN7 1/20 0.57
▸ TRPV1 Q8NER1 4/20 0.55
▸ NPC1 O15118 3/20 0.55
▸ RAB9A P51151 3/20 0.55
▸ SMN1; SMN2 Q16637 2/20 0.55
▸ KCNK9 Q9NPC2 1/20 0.53
▸ TP53 P04637 1/20 0.52
▸ THRB P10828 1/20 0.52
▸ MEN1 O00255 2/20 0.51
▸ KMT2A Q03164 2/20 0.51
▸ NAMPT P43490 1/20 0.51
▸ KDM4E B2RXH2 1/20 0.51
▸ CYP1A2 P05177 1/20 0.51
▸ CYP2C9 P11712 1/20 0.51
▸ HPGD P15428 1/20 0.51

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
SCHEMBL8885243 0.83 DHPS (0.55) CFTRDHPSHDAC3HDAC11HDAC8
SCHEMBL21652185 0.82 SMN1; SMN2 (0.74) DHPSHDAC3HDAC11HDAC8HDAC6
SCHEMBL7302565 0.81 KCNK9 (0.76) HDAC3HDAC11HDAC8HDAC6TRPV1
SCHEMBL3822225 0.81 PTGS1 (0.73) CFTRDHPSHDAC3HDAC11HDAC8
SCHEMBL7300718 0.81 SMO (0.69) DHPSTRPV1NPC1RAB9ASMN1; SMN2
SCHEMBL21652187 0.81 MEN1 (0.68) CFTRDHPSHDAC3HDAC11HDAC8
SCHEMBL1496348 0.81 CA12 (0.58) CFTRDHPSHDAC3HDAC11HDAC8
SCHEMBL7190812 0.80 DHPS (0.62) CFTRDHPSHDAC3HDAC11HDAC8
SCHEMBL10055004 0.80 MEN1 (0.71) CFTRNPC1RAB9ASMN1; SMN2TP53
SCHEMBL8376765 0.80 CA1 (0.59) CFTRDHPSHDAC3HDAC11HDAC8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5468583-A Photoconductor element EASTMAN KODAK COMPANY (US) 1995-11-21 — — US disclosed
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