SCHEMBL10197595

SCHEMBL10197595

CC(C)(C)NC(=O)c1cccc(C(C)(C)C)c1

nearest known ligand 0.57

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HDAC8 Q9BY41 2/20 0.57
HDAC6 Q9UBN7 2/20 0.57
ACHE P22303 3/20 0.57
NR1H4 Q96RI1 1/20 0.54
LMNA P02545 3/20 0.51
KMT2A Q03164 2/20 0.50
MEN1 O00255 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
HDAC3 O15379 1/20 0.49
CYP2C19 P33261 1/20 0.49
ANO1 Q5XXA6 1/20 0.48
NPC1 O15118 1/20 0.48
HTT P42858 1/20 0.48
RAB9A P51151 1/20 0.48
NPSR1 Q6W5P4 1/20 0.47
KCNK9 Q9NPC2 1/20 0.47

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
SCHEMBL21249304 0.87 LMNA (0.58) HDAC8HDAC6LMNAKMT2ASMN1; SMN2
SCHEMBL7647660 0.86 NPSR1 (0.65) LMNAKMT2AMEN1HDAC3ANO1
SCHEMBL21095553 0.86 HDAC8 (0.66) HDAC8HDAC6NR1H4LMNAKMT2A
SCHEMBL10120025 0.84 HDAC8 (0.59) HDAC8HDAC6ACHENR1H4KMT2A
SCHEMBL12201883 0.84 HDAC8 (0.77) HDAC8HDAC6ACHENR1H4KMT2A
SCHEMBL13698098 0.82 ACHE (0.60) HDAC8HDAC6ACHENR1H4KMT2A
SCHEMBL22524754 0.80 LMNA (0.56) LMNAKMT2AMEN1SMN1; SMN2CYP2C19
SCHEMBL159046 0.80 LMNA (0.52) LMNAKMT2AMEN1CYP2C19ANO1
SCHEMBL13701766 0.80 S100B (0.60) LMNAKMT2AMEN1SMN1; SMN2CYP2C19
SCHEMBL159047 0.80 KDM4E (0.61) LMNAKMT2AMEN1CYP2C19ANO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10716801-B2 Silanol based therapeutic payloads BLINKBIO, INC. (US) 2020-07-21 US disclosed
US-20190183913-A1 Silanol Based Therapeutic Payloads BLINKBIO INC (US) 2019-06-20 US disclosed
US-10301255-B2 Hepatitis B antiviral agents ENANTA PHARMACEUTICALS, INC. (US) 2019-05-28 US disclosed
US-10293053-B2 Silanol based therapeutic payloads BLINKBIO, INC. (US) 2019-05-21 US disclosed
US-20180200273-A1 Silanol Based Therapeutic Payloads BLINKBIO INC (US) 2018-07-19 US disclosed
US-20170022150-A1 HEPATITIS B ANTIVIRAL AGENTS ENANTA PHARMACEUTICALS, INC. 2017-01-26 US disclosed
US-20170022150-A1 HEPATITIS B ANTIVIRAL AGENTS ENANTA PHARMACEUTICALS, INC. 2017-01-26 US disclosed
US-20140243335-A1 SUBSTITUTED HYDOXAMIC ACIDS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2014-08-28 US disclosed
US-20140243334-A1 SUBSTITUTED HYDOXAMIC ACIDS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2014-08-28 US disclosed
US-8513421-B2 Substituted hydroxamic acids and uses thereof MILLENNIUM PHARMACEUTICALS, INC. (US) 2013-08-20 US disclosed
US-20120015942-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2012-01-19 US disclosed
US-20120015943-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF MILLENNIUM PHARMACUTICALS, INC. (US) 2012-01-19 US disclosed
US-20110288117-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF MILLENNIUM PHARMACEUTICALS, INC. (US) 2011-11-24 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 (11 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-10301255-B2 Hepatitis B antiviral agents HAVCR2, ZC3HAV1, SLC10A1 HDAC8 1574/4885HDAC6 2426/4885ACHE 4469/4885
US-20190183913-A1 Silanol Based Therapeutic Payloads CD47, CD4, BST2 HDAC8 501/4885HDAC6 586/4885ACHE 4785/4885
US-20170022150-A1 HEPATITIS B ANTIVIRAL AGENTS HAVCR2, ZC3HAV1, SLC10A1 HDAC8 1574/4885HDAC6 2426/4885ACHE 4469/4885
US-20120015942-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF HDAC6, HDAC1, HDAC2 HDAC8 13/4885HDAC6 1/4885ACHE 3602/4885
US-10716801-B2 Silanol based therapeutic payloads CD47, CD4, BST2 HDAC8 501/4885HDAC6 586/4885ACHE 4785/4885
US-20180200273-A1 Silanol Based Therapeutic Payloads CD47, CD4, BST2 HDAC8 501/4885HDAC6 586/4885ACHE 4785/4885
US-20140243334-A1 SUBSTITUTED HYDOXAMIC ACIDS AND USES THEREOF HDAC6, H1-3, H1-5 HDAC8 19/4885HDAC6 1/4885ACHE 1149/4885
US-20110288117-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF HDAC6, HDAC1, HDAC5 HDAC8 11/4885HDAC6 1/4885ACHE 3502/4885
US-10293053-B2 Silanol based therapeutic payloads CD47, CD4, BST2 HDAC8 501/4885HDAC6 586/4885ACHE 4785/4885
US-20120015943-A1 SUBSTITUTED HYDROXAMIC ACIDS AND USES THEREOF HDAC6, HDAC1, HDAC2 HDAC8 13/4885HDAC6 1/4885ACHE 3488/4885
US-20140243335-A1 SUBSTITUTED HYDOXAMIC ACIDS AND USES THEREOF HDAC6, HDAC1, H1-3 HDAC8 20/4885HDAC6 1/4885ACHE 1462/4885

“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.