SCHEMBL17899616

SCHEMBL17899616

CNC(=O)c1ccc(S(=O)(=O)N2CC=C(C(=O)NO)C2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 2/20 0.47
HDAC2 Q92769 1/20 0.47
HDAC8 Q9BY41 1/20 0.47
CA2 P00918 1/20 0.46
GAA P10253 1/20 0.43
HTT P42858 1/20 0.43
ALDH1A1 P00352 4/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
TDP1 Q9NUW8 1/20 0.42
CA12 O43570 1/20 0.42
CA1 P00915 1/20 0.42
CA9 Q16790 1/20 0.42
LMNA P02545 3/20 0.41
MAPT P10636 1/20 0.41
HPGD P15428 1/20 0.41
RECQL P46063 1/20 0.41
HDAC1 Q13547 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
USP2 O75604 1/20 0.41

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
SCHEMBL19472030 0.93 CA2 (0.49) CA2GAAHTTALDH1A1SMN1; SMN2
SCHEMBL19559856 0.88 CA2 (0.50) CA2GAAHTTALDH1A1SMN1; SMN2
SCHEMBL17899621 0.87 AKR1C3 (0.47) HDAC6ALDH1A1SMN1; SMN2LMNAMAPT
SCHEMBL19472037 0.86 AKR1C3 (0.46) GAAHTTALDH1A1SMN1; SMN2TDP1
SCHEMBL17899605 0.85 LMNA (0.55) HDAC6HDAC2HDAC8TDP1LMNA
SCHEMBL17899611 0.85 LMNA (0.49) HDAC6HDAC8GAAALDH1A1LMNA
SCHEMBL17899608 0.83 PKM (0.50) HDAC6HDAC2HDAC8GAAALDH1A1
SCHEMBL19472038 0.83 LMNA (0.55) HTTALDH1A1TDP1LMNAMAPT
SCHEMBL17899618 0.82 HDAC1 (0.46) HDAC6HDAC2HDAC8ALDH1A1SMN1; SMN2
SCHEMBL17899600 0.82 KMT2A (0.56) GAAHTTALDH1A1MAPTHDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10266489-B2 Pyrrolic amide compound and preparation method and application thereof HITGEN LTD (CN) 2019-04-23 US disclosed
US-10266489-B2 Pyrrolic amide compound and preparation method and application thereof HITGEN LTD (CN) 2019-04-23 US disclosed
EP-3241823-B1 PYRROLE AMIDE COMPOUND, PREPARATION METHOD THEREFOR, AND USE THEREOF HITGEN LTD (CN) 2019-04-17 EP disclosed
EP-3241823-B1 PYRROLE AMIDE COMPOUND, PREPARATION METHOD THEREFOR, AND USE THEREOF HITGEN LTD (CN) 2019-04-17 EP disclosed
EP-3241823-A1 PYRROLE AMIDE COMPOUND, PREPARATION METHOD THEREFOR, AND USE THEREOF Hitgen Ltd. (CN) 2017-11-08 EP disclosed
EP-3241823-A1 PYRROLE AMIDE COMPOUND, PREPARATION METHOD THEREFOR, AND USE THEREOF Hitgen Ltd. (CN) 2017-11-08 EP disclosed
US-20170298016-A1 PYRROLIC AMIDE COMPOUND AND PREPARATION METHOD AND APPLICATION THEREOF HITGEN INC. (CN) 2017-10-19 US disclosed
US-20170298016-A1 PYRROLIC AMIDE COMPOUND AND PREPARATION METHOD AND APPLICATION THEREOF HITGEN INC. (CN) 2017-10-19 US disclosed
US-20170298016-A1 PYRROLIC AMIDE COMPOUND AND PREPARATION METHOD AND APPLICATION THEREOF HITGEN INC. (CN) 2017-10-19 US disclosed
WO-2016107227-A1 PYRROLE AMIDE COMPOUND, PREPARATION METHOD THEREFOR, AND USE THEREOF 成都先导药物开发有限公司 2016-07-07 WO disclosed
WO-2016107544-A1 INTERMEDIATE COMPOUND FOR PREPARING PYRROLE AMIDE COMPOUND AND PREPARATION METHOD AND USE THEREOF 成都先导药物开发有限公司 2016-07-07 WO 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-20170298016-A1 PYRROLIC AMIDE COMPOUND AND PREPARATION METHOD AND APPLICATION THEREOF HDAC1, HDAC3, HDAC11 HDAC6 5/4885HDAC2 4/4885HDAC8 11/4885
US-10266489-B2 Pyrrolic amide compound and preparation method and application thereof HDAC1, HDAC3, HDAC11 HDAC6 5/4885HDAC2 4/4885HDAC8 11/4885

“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.