SCHEMBL10283555

SCHEMBL10283555

Cc1nc(C(=O)N2C3CCC2c2cc(C(=O)NO)ccc23)cs1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TLR7 Q9NYK1 3/20 0.42
▸ KDM4E B2RXH2 2/20 0.40
▸ GFER P55789 1/20 0.40
▸ NPC1 O15118 3/20 0.37
▸ RAB9A P51151 3/20 0.37
▸ MEN1 O00255 2/20 0.37
▸ KMT2A Q03164 2/20 0.37
▸ SMN1; SMN2 Q16637 2/20 0.37
▸ POLB P06746 1/20 0.37
▸ MAPT P10636 1/20 0.37
▸ NFKB1 P19838 1/20 0.37
▸ MAPK1 P28482 1/20 0.37
▸ NFKB2 Q00653 1/20 0.37
▸ RELA Q04206 1/20 0.37
▸ ALDH1A1 P00352 1/20 0.37
▸ PKM P14618 1/20 0.37
▸ HDAC6 Q9UBN7 2/20 0.36
▸ HDAC8 Q9BY41 2/20 0.35
▸ BCAT2 O15382 1/20 0.35
▸ HPGD P15428 1/20 0.35

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
SCHEMBL10247007 0.79 HDAC8 (0.43) TLR7NPC1RAB9AMEN1KMT2A
SCHEMBL10254420 0.79 HDAC8 (0.43) TLR7NPC1RAB9AMEN1KMT2A
SCHEMBL10253390 0.74 HDAC8 (0.44) MAPTHDAC6HDAC8
SCHEMBL15969508 0.74 HDAC1 (0.54) MEN1KMT2ASMN1; SMN2ALDH1A1HDAC6
SCHEMBL10252696 0.74 CA1 (0.52) POLBHDAC6HDAC8HPGD
SCHEMBL15969748 0.73 HDAC6 (0.52) HDAC6HDAC8
SCHEMBL10283624 0.72 HDAC6 (0.52) HDAC6HDAC8
SCHEMBL356659 0.72 HDAC6 (0.58) NPC1RAB9AKMT2AHDAC6HDAC8
SCHEMBL10283554 0.71 KDM4E (0.54) KDM4ERAB9AKMT2APOLBMAPT
SCHEMBL10254207 0.71 HDAC8 (0.37) HDAC6HDAC8

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-20140243335-A1 SUBSTITUTED HYDOXAMIC ACIDS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2014-08-28 — — US disclosed
US-20140243335-A1 SUBSTITUTED HYDOXAMIC ACIDS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2014-08-28 — — US disclosed
US-20120015943-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF MILLENNIUM PHARMACUTICALS, INC. (US) 2012-01-19 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120015943-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF HDAC6, HDAC1, HDAC2 TLR7 986/4885KDM4E 668/4885GFER 3798/4885
US-20140243335-A1 SUBSTITUTED HYDOXAMIC ACIDS AND USES THEREOF HDAC6, HDAC1, H1-3 TLR7 1172/4885KDM4E 597/4885GFER 2132/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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