SCHEMBL15424134

SCHEMBL15424134

CN(C)c1ccc2[nH]c(-c3cc(NC(=O)c4ccc(S(=O)(=O)N5CCN(c6ncc(C(=O)NO)cn6)CC5)cc4Cl)ccc3Cl)nc2c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HDAC3 O15379 3/20 0.46
▸ HDAC1 Q13547 3/20 0.46
▸ HDAC2 Q92769 3/20 0.46
▸ HDAC6 Q9UBN7 3/20 0.46
▸ HDAC4 P56524 2/20 0.46
▸ HDAC7 Q8WUI4 2/20 0.46
▸ HDAC10 Q969S8 2/20 0.46
▸ HDAC11 Q96DB2 2/20 0.46
▸ HDAC8 Q9BY41 2/20 0.46
▸ HDAC9 Q9UKV0 2/20 0.46
▸ HDAC5 Q9UQL6 2/20 0.46
▸ USP28 Q96RU2 3/20 0.44
▸ PDE5A O76074 1/20 0.42
▸ NCOR2 Q9Y618 1/20 0.42
▸ MEN1 O00255 1/20 0.39
▸ HTT P42858 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ MAPT P10636 2/20 0.38
▸ KDM4E B2RXH2 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.38

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
SCHEMBL15424136 0.89 HDAC3 (0.54) HDAC3HDAC1HDAC2HDAC6HDAC4
SCHEMBL15424137 0.89 USP28 (0.40) HDAC3HDAC1HDAC2HDAC6HDAC4
SCHEMBL15424197 0.85 USP28 (0.47) USP28MEN1HTTKMT2AMAPT
SCHEMBL15424151 0.80 MEN1 (0.49) HDAC3HDAC1HDAC2HDAC6MEN1
SCHEMBL15425122 0.80 HDAC3 (0.44) HDAC3HDAC1HDAC2HDAC6USP28
SCHEMBL15425118 0.79 MEN1 (0.42) HDAC3HDAC1HDAC2HDAC6USP28
SCHEMBL19916676 0.78 USP28 (0.47) USP28MEN1HTTKMT2AMAPT
SCHEMBL15424142 0.78 MEN1 (0.46) HDAC3HDAC1HDAC2HDAC6HDAC4
SCHEMBL15424133 0.78 USP28 (0.61) HDAC3HDAC1HDAC2HDAC6HDAC4
SCHEMBL19132659 0.78 USP28 (0.53) USP28MEN1HTTKMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2661425-B1 HEDGEHOG ANTAGONISTS HAVING ZINC BINDING MOIETIES CURIS INC (US) 2018-02-28 — — EP disclosed
US-20170349573-A1 HEDGEHOG ANTAGONISTS HAVING ZINC BINDING MOIETIES CURIS INC (US) 2017-12-07 — — US disclosed
US-9708299-B2 Hedgehog antagonists having zinc binding moieties GENENTECH, INC. (US) 2017-07-18 — — US disclosed
US-9708299-B2 Hedgehog antagonists having zinc binding moieties GENENTECH, INC. (US) 2017-07-18 — — US disclosed
US-20140018368-A1 HEDGEHOG ANTAGONISTS HAVING ZINC BINDING MOIETIES GENETECH, INC. (US) 2014-01-16 — — US disclosed
US-20140018368-A1 HEDGEHOG ANTAGONISTS HAVING ZINC BINDING MOIETIES GENETECH, INC. (US) 2014-01-16 — — 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-20170349573-A1 HEDGEHOG ANTAGONISTS HAVING ZINC BINDING MOIETIES GLI1, SHH, HDAC1 HDAC3 7/4885HDAC1 3/4885HDAC2 16/4885
US-20140018368-A1 HEDGEHOG ANTAGONISTS HAVING ZINC BINDING MOIETIES GLI1, SHH, HDAC1 HDAC3 7/4885HDAC1 3/4885HDAC2 16/4885

“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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