SCHEMBL11348366

SCHEMBL11348366

COC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CCCCCCN

nearest known ligand 0.65

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ HDAC1 Q13547 6/20 0.65
▸ HDAC6 Q9UBN7 6/20 0.65
▸ CHRND Q07001 5/20 0.61
▸ CHRNA1 P02708 1/20 0.61
▸ CHRNG P07510 1/20 0.61
▸ CHRNB1 P11230 1/20 0.61
▸ GRIA1 P42261 3/20 0.59

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
SCHEMBL11348361 1.00 HDAC1 (0.65) HDAC1HDAC6CHRNDCHRNA1CHRNG
SCHEMBL9203106 0.90 MDM4 (0.64) HDAC1HDAC6CHRND
SCHEMBL9203104 0.90 MDM4 (0.64) HDAC1HDAC6CHRND
SCHEMBL14472130 0.89 HDAC1 (0.66) HDAC1HDAC6GRIA1
SCHEMBL27910970 0.89 HDAC1 (0.66) HDAC1HDAC6GRIA1
SCHEMBL18220518 0.89 HDAC1 (0.66) HDAC1HDAC6GRIA1
SCHEMBL14472192 0.89 HDAC1 (0.66) HDAC1HDAC6GRIA1
SCHEMBL2337076 0.89 HDAC1 (0.66) HDAC1HDAC6GRIA1
SCHEMBL43741 0.87 HDAC1 (0.64) HDAC1HDAC6GRIA1
SCHEMBL42986 0.87 HDAC1 (0.64) HDAC1HDAC6GRIA1

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
US-4277460-A RADIOACTIVE IODINE DAIICHI RADIOISOTOPE LABORATORIES, LTD. (JP) 1981-07-07 — — US disclosed
US-4190593-A AMIDES OF 6-ALPHA-CARBOXYMETHYLTHIOCORTISOL DAIICHI RADIOISOTOPE LABORATORIES, LTD. (JP) 1980-02-26 — — US disclosed
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