SCHEMBL2830160

SCHEMBL2830160

NC(=O)c1cc2ccccc2n1Cl

nearest known ligand 0.54

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PLA2G10 O15496 8/20 0.54
CCR2 P41597 3/20 0.54
DAO P14920 1/20 0.52
SLC9A1 P19634 1/20 0.50
MCL1 Q07820 1/20 0.50
ALDH1A1 P00352 1/20 0.49
TSHR P16473 1/20 0.49
F10 P00742 2/20 0.48
ROCK2 O75116 1/20 0.42
PIM1 P11309 1/20 0.42
PIM3 Q86V86 1/20 0.42

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
Hydrochloric Acid SCHEMBL27784064 0.98 PLA2G10 (0.53) PLA2G10CCR2DAOSLC9A1MCL1
SCHEMBL16599057 0.86 DAO (0.53) PLA2G10CCR2DAOSLC9A1MCL1
SCHEMBL30305558 0.84 DAO (0.67) PLA2G10CCR2DAOSLC9A1MCL1
SCHEMBL4327040 0.84 DAO (0.52) PLA2G10CCR2DAOSLC9A1MCL1
SCHEMBL2940271 0.84 DAO (0.67) PLA2G10CCR2DAOSLC9A1MCL1
SCHEMBL7670332 0.82 DAO (0.70) PLA2G10CCR2DAOSLC9A1MCL1
SCHEMBL4103400 0.82 PLA2G10 (0.53) PLA2G10CCR2DAOSLC9A1MCL1
SCHEMBL5570219 0.81 PLA2G10 (0.51) PLA2G10CCR2DAOSLC9A1MCL1
SCHEMBL2323444 0.81 MCL1 (0.71) PLA2G10DAOSLC9A1MCL1
SCHEMBL19691145 0.81 PLA2G10 (0.51) PLA2G10CCR2DAOSLC9A1MCL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117603188-A Indole and quinoline skeleton-containing compound and application thereof 苏州卫生职业技术学院 2024-02-27 CN disclosed
US-20230101819-A1 SMYD Inhibitors EPIZYME INC (US) 2023-03-30 US disclosed
US-20210198252-A1 SMYD INHIBITORS EPIZYME INC (US) 2021-07-01 US disclosed
US-20190322660-A1 SMYD INHIBITORS Epizyme, Inc. 2019-10-24 US disclosed
US-10266526-B2 Substituted 1,2,3-triazoles as SMYD inhibitors for treating cancer Epizyme, Inc. (US) 2019-04-23 US disclosed
CN-108349949-A N- substituted indole derivatives as PGE2 receptor modulators 爱杜西亚药品有限公司 2018-07-31 CN disclosed
US-20170355695-A1 SMYD Inhibitors Epizyme, Inc. (US) 2017-12-14 US disclosed
CN-103201276-B Indole derivatives RICHTER GEDEON NYRT 2015-02-25 CN disclosed
CN-103201276-A Indole derivatives RICHTER GEDEON NYRT 2013-07-10 CN disclosed
US-20100166701-A1 METHOD FOR TREATING RENAL CELL CARCINOMA USING GLYCOGENOLYSIS INHIBITORS PARKER GLENDON JOHN 2010-07-01 US disclosed
EP-0686148-A4 INHIBITORS OF HIV REVERSE TRANSCRIPTASE MERCK & CO INC (US) 1996-02-07 EP disclosed
EP-0686148-A1 INHIBITORS OF HIV REVERSE TRANSCRIPTASE MERCK & CO. INC. (US) 1995-12-13 EP 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 (5 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-10266526-B2 Substituted 1,2,3-triazoles as SMYD inhibitors for treating cancer SMYD3, SMYD2, SNRPD3 PLA2G10 4418/4885CCR2 4343/4885DAO 2022/4885
US-20170355695-A1 SMYD Inhibitors SMYD3, SMYD2, SMURF2 PLA2G10 3433/4885CCR2 4465/4885DAO 1624/4885
US-20210198252-A1 SMYD INHIBITORS SMYD3, SMYD2, SMURF2 PLA2G10 3432/4885CCR2 4467/4885DAO 1686/4885
US-20190322660-A1 SMYD INHIBITORS SMYD2, SMYD3, SMURF2 PLA2G10 3520/4885CCR2 3779/4885DAO 1694/4885
US-20230101819-A1 SMYD Inhibitors SMYD3, SMYD2, SMURF2 PLA2G10 3406/4885CCR2 4452/4885DAO 1573/4885

“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.