SCHEMBL420926

SCHEMBL420926

O=C(C=Cc1ccc(-c2ccccc2)cc1)Nc1ccc(Cl)cc1C(=O)O

nearest known ligand 0.74

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TRPM2 O94759 5/20 0.74
LTB4R Q15722 4/20 0.72
TRPA1 O75762 4/20 0.70
EGFR P00533 1/20 0.64
SERPINE1 P05121 2/20 0.63
MEN1 O00255 2/20 0.58
NPC1 O15118 2/20 0.58
RAB9A P51151 2/20 0.58
KMT2A Q03164 2/20 0.58
SMN1; SMN2 Q16637 2/20 0.58
KDM4E B2RXH2 1/20 0.58
ALDH1A1 P00352 1/20 0.58
HPGD P15428 1/20 0.58
NPSR1 Q6W5P4 1/20 0.58
TRPM8 Q7Z2W7 1/20 0.56
CTDSP1 Q9GZU7 1/20 0.56
TP53 P04637 1/20 0.55
HDAC2 Q92769 1/20 0.54
MAPT P10636 1/20 0.53

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
SCHEMBL420925 1.00 TRPM2 (0.74) TRPM2LTB4RTRPA1EGFRSERPINE1
SCHEMBL8060454 0.92 EGFR (0.75) TRPM2LTB4RTRPA1EGFRMEN1
SCHEMBL8060457 0.92 EGFR (0.75) TRPM2LTB4RTRPA1EGFRMEN1
SCHEMBL8065880 0.91 TRPA1 (0.75) TRPM2LTB4RTRPA1EGFRMEN1
SCHEMBL8065883 0.91 TRPA1 (0.75) TRPM2LTB4RTRPA1EGFRMEN1
SCHEMBL417073 0.90 EGFR (0.62) TRPM2LTB4RTRPA1EGFRSERPINE1
SCHEMBL417074 0.90 EGFR (0.62) TRPM2LTB4RTRPA1EGFRSERPINE1
SCHEMBL418156 0.88 ALDH1A1 (0.59) TRPM2LTB4RTRPA1EGFRMEN1
SCHEMBL418157 0.88 ALDH1A1 (0.59) TRPM2LTB4RTRPA1EGFRMEN1
SCHEMBL2271618 0.86 TRPA1 (0.73) TRPM2LTB4RTRPA1EGFRMEN1

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
CN-114831977-A Application of benzoic acid derivatives as TRPM2 protein inhibitors 北京大学 2022-08-02 CN claimed
CN-114831977-B Application of benzoic acid derivative as TRPM2 protein inhibitor 北京大学 2023-12-19 CN disclosed
CN-114831977-A Application of benzoic acid derivatives as TRPM2 protein inhibitors 北京大学 2022-08-02 CN disclosed
EP-2607348-B1 Plasminogen Activator Inhibitor-1 Inhibitor RENASCIENCE INC (JP) 2021-03-17 EP disclosed
EP-2990057-B1 PAI-1 INHIBITOR FOR USE IN ENHANCING THE ANTITUMOR EFFECT OF AN ANTITUMOR AGENT IN A PATIENT RENASCIENCE CO LTD (JP) 2019-03-20 EP disclosed
US-10092537-B2 Use for PAI-1 inhibitor RENASCIENCE CO., LTD. (JP) 2018-10-09 US disclosed
US-20160158188-A1 NOVEL USE FOR PAI-1 INHIBITOR RENASCIENCE CO., LTD. (JP) 2016-06-09 US disclosed
EP-2990057-A1 NOVEL USE FOR PAI-1 INHIBITOR Renascience Co., Ltd. (JP) 2016-03-02 EP disclosed
US-20140296256-A1 PLASMINOGEN ACTIVATOR INHIBITOR-1 INHIBITOR RENASCIENCE CO LTD (JP) 2014-10-02 US disclosed
US-8785473-B2 Plasminogen activator inhibitor-1 inhibitor RENASCIENCE CO., LTD. (JP) 2014-07-22 US disclosed
EP-2607348-A2 Plasminogen Activator Inhibitor-1 Inhibitor Renascience CO., LTD. (JP) 2013-06-26 EP disclosed
EP-2415755-A1 PLASMINOGEN ACTIVATOR INHIBITOR-1 INHIBITOR Renascience CO., LTD. (JP) 2012-02-08 EP disclosed
US-20120022080-A1 Plasminogen Activator Inhibitor-1 Inhibitor RENASCIENCE CO., LTD. (JP) 2012-01-26 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 (4 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-20160158188-A1 NOVEL USE FOR PAI-1 INHIBITOR SERPINE1, SERPINC1, SERPINB1 TRPM2 4652/4885LTB4R 2382/4885TRPA1 4798/4885
US-20140296256-A1 PLASMINOGEN ACTIVATOR INHIBITOR-1 INHIBITOR SERPINE1, SERPINC1, SERPINB1 TRPM2 3818/4885LTB4R 885/4885TRPA1 4141/4885
US-20120022080-A1 Plasminogen Activator Inhibitor-1 Inhibitor SERPINE1, SERPINC1, SERPINB1 TRPM2 3818/4885LTB4R 885/4885TRPA1 4141/4885
US-10092537-B2 Use for PAI-1 inhibitor SERPINE1, SERPINC1, SERPINB1 TRPM2 4660/4885LTB4R 2350/4885TRPA1 4776/4885

“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.