SCHEMBL2412460

SCHEMBL2412460

CC(NC(=O)c1ccc2ccccc2n1)c1ccc(C(=O)NO)cc1

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC8 Q9BY41 2/20 0.61
HDAC6 Q9UBN7 3/20 0.56
HDAC1 Q13547 3/20 0.56
SMN1; SMN2 Q16637 3/20 0.49
ALDH1A1 P00352 3/20 0.49
GAA P10253 2/20 0.49
LMNA P02545 1/20 0.49
MAPT P10636 1/20 0.49
RAB9A P51151 4/20 0.48
NPC1 O15118 4/20 0.48
HPGD P15428 2/20 0.48
TP53 P04637 1/20 0.48
POLB P06746 1/20 0.48
NFKB1 P19838 1/20 0.47
NFKB2 Q00653 1/20 0.47
RELA Q04206 1/20 0.47
CASP3 P42574 1/20 0.45
KMT2A Q03164 1/20 0.45
SENP8 Q96LD8 1/20 0.45
SENP7 Q9BQF6 1/20 0.45

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
SCHEMBL2405077 0.79 MMP9 (0.58) HDAC8HDAC6HDAC1SMN1; SMN2ALDH1A1
SCHEMBL2407415 0.78 SMN1; SMN2 (0.77) HDAC8HDAC6HDAC1SMN1; SMN2ALDH1A1
SCHEMBL12043742 0.78 HDAC8 (0.65) HDAC8SMN1; SMN2ALDH1A1GAALMNA
SCHEMBL7010475 0.78 HDAC8 (1.00) HDAC8HDAC6HDAC1SMN1; SMN2ALDH1A1
SCHEMBL18530693 0.78 HDAC8 (1.00) HDAC8HDAC6HDAC1SMN1; SMN2ALDH1A1
SCHEMBL12837822 0.74 HDAC8 (0.60) HDAC8HDAC6HDAC1SMN1; SMN2ALDH1A1
SCHEMBL403689 0.74 HDAC8 (0.60) HDAC8HDAC6HDAC1SMN1; SMN2ALDH1A1
SCHEMBL13127973 0.74 HDAC8 (0.59) HDAC8SMN1; SMN2ALDH1A1GAAMAPT
SCHEMBL14885252 0.74 HDAC3 (0.60) HDAC6HDAC1SMN1; SMN2ALDH1A1LMNA
SCHEMBL2413088 0.74 ROCK2 (0.68) HDAC8HDAC6HDAC1SMN1; SMN2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9382197-B2 Substituted hydroxamic acids and uses thereof MILLENNIUM PHARMACEUTICALS, INC. (US) 2016-07-05 US disclosed
US-9382197-B2 Substituted hydroxamic acids and uses thereof MILLENNIUM PHARMACEUTICALS, INC. (US) 2016-07-05 US disclosed
US-9382197-B2 Substituted hydroxamic acids and uses thereof MILLENNIUM PHARMACEUTICALS, INC. (US) 2016-07-05 US disclosed
US-20140275093-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2014-09-18 US disclosed
US-20140275093-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2014-09-18 US disclosed
US-20140275093-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2014-09-18 US disclosed
WO-2011106632-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2011-09-01 WO disclosed
US-20110212969-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2011-09-01 US disclosed
US-20110212969-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2011-09-01 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-20140275093-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF HDAC6, HDAC10, HDAC1 HDAC8 15/4885HDAC6 1/4885HDAC1 3/4885
US-20110212969-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF HDAC6, HDAC10, HDAC1 HDAC8 15/4885HDAC6 1/4885HDAC1 3/4885

“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.