SCHEMBL19380277

SCHEMBL19380277

CC1C(=O)N(O)C(=O)c2cc(NC(=O)c3ccccc3)ccc21

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ACE2 Q9BYF1 1/20 0.51
▸ KCNK9 Q9NPC2 3/20 0.49
▸ KCNK3 O14649 2/20 0.49
▸ CASP3 P42574 2/20 0.46
▸ KMT2A Q03164 4/20 0.46
▸ POLB P06746 3/20 0.46
▸ MEN1 O00255 2/20 0.45
▸ KDM4E B2RXH2 1/20 0.45
▸ MAPT P10636 1/20 0.45
▸ RPS6KA2 Q15349 2/20 0.45
▸ RAB9A P51151 7/20 0.45
▸ NPC1 O15118 6/20 0.45
▸ SIRT1 Q96EB6 1/20 0.45
▸ NLRP3 Q96P20 1/20 0.44
▸ HPGD P15428 1/20 0.44

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
SCHEMBL15300231 0.73 ACE2 (0.55) ACE2KCNK9KCNK3CASP3KMT2A
SCHEMBL20777907 0.72 ACHE (0.58) ACE2KCNK9KCNK3CASP3KMT2A
SCHEMBL4289564 0.70 ACE2 (0.97) ACE2KCNK9KCNK3CASP3KMT2A
SCHEMBL25970373 0.70 ACE2 (0.97) ACE2KCNK9KCNK3CASP3KMT2A
SCHEMBL11527428 0.69 ALDH1A1 (0.69) ACE2CASP3KMT2APOLBMEN1
SCHEMBL8528763 0.68 ACE2 (1.00) ACE2KCNK9KCNK3CASP3KMT2A
SCHEMBL30519331 0.68 ACE2 (1.00) ACE2KCNK9KCNK3CASP3KMT2A
SCHEMBL2298254 0.68 KCNK3 (1.00) KCNK9KCNK3KMT2APOLBMEN1
SCHEMBL14715851 0.67 KMT2A (0.79) KCNK9KCNK3KMT2APOLBMEN1
SCHEMBL7990078 0.67 RAB9A (0.54) KCNK9KCNK3KMT2APOLBMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190070165-A1 N-HYDROXYISOQUINOLINEDIONE INHIBITORS OF HBV REPLICATION SAINT LOUIS UNIVERSITY (US) 2019-03-07 — — US disclosed
WO-2017161133-A1 N-HYDROXYISOQUINOLINEDIONE INHIBITORS OF HBV REPLICATION SAINT LOUIS UNIVERSITY (US) 2017-09-21 — — 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 (1 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-20190070165-A1 N-HYDROXYISOQUINOLINEDIONE INHIBITORS OF HBV REPLICATION HCCS, HAVCR2, HDGF ACE2 1397/4885KCNK9 4821/4885KCNK3 4833/4885

“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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