SCHEMBL418660

SCHEMBL418660

Cn1c(C(=O)Nc2ccc(Cl)cc2C(=O)O)cc2cc(Br)ccc21

nearest known ligand 0.57

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 1/20 0.57
RXFP1 Q9HBX9 1/20 0.57
KDM4E B2RXH2 1/20 0.49
HSD17B10 Q99714 1/20 0.49
DNMT3A Q9Y6K1 1/20 0.48
PHGDH O43175 4/20 0.48
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
SERPINE1 P05121 3/20 0.47
LMNA P02545 3/20 0.47
TP53 P04637 1/20 0.47
MAPT P10636 1/20 0.47
AKR1C4 P17516 1/20 0.46
AKR1C3 P42330 1/20 0.46
AKR1C2 P52895 1/20 0.46
AKR1C1 Q04828 1/20 0.46

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
SCHEMBL420313 0.89 MAPT (0.58) MCL1RXFP1KDM4EHSD17B10PHGDH
SCHEMBL6830542 0.85 GRM4 (0.55) MCL1RXFP1KDM4EHSD17B10PHGDH
SCHEMBL417998 0.85 SERPINE1 (0.61) RXFP1KDM4EHSD17B10PHGDHMEN1
SCHEMBL6835781 0.83 MCL1 (0.55) MCL1PHGDHMEN1KMT2ALMNA
SCHEMBL19554148 0.76 DHODH (0.70) DNMT3AMEN1KMT2ASERPINE1MAPT
SCHEMBL419152 0.76 MAPT (0.60) RXFP1KDM4EHSD17B10PHGDHMEN1
SCHEMBL418126 0.75 MCL1 (1.00) MCL1KDM4EHSD17B10
SCHEMBL417918 0.73 MEN1 (0.53) KDM4EHSD17B10DNMT3AMEN1KMT2A
SCHEMBL6833093 0.72 MCL1 (0.56) MCL1PHGDHMEN1KMT2ALMNA
SCHEMBL1307332 0.72 PPARG (0.71) KDM4EHSD17B10DNMT3AMEN1KMT2A

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
US-20220340665-A1 INHIBITOR AGAINST EXPRESSION OF IMMUNE CHECKPOINT MOLECULE RENASCIENCE INC. (JP) 2022-10-27 US disclosed
EP-4039276-A1 INHIBITOR AGAINST EXPRESSION OF IMMUNE CHECKPOINT MOLECULE Renascience Inc. (JP) 2022-08-10 EP 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
CN-102378753-A Plasminogen activator inhibitor-1 inhibitor RENASCIENCE CO LTD 2012-03-14 CN 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 (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-20160158188-A1 NOVEL USE FOR PAI-1 INHIBITOR SERPINE1, SERPINC1, SERPINB1 MCL1 21/4885RXFP1 3001/4885KDM4E 4253/4885
US-20140296256-A1 PLASMINOGEN ACTIVATOR INHIBITOR-1 INHIBITOR SERPINE1, SERPINC1, SERPINB1 MCL1 1685/4885RXFP1 947/4885KDM4E 4490/4885
US-20120022080-A1 Plasminogen Activator Inhibitor-1 Inhibitor SERPINE1, SERPINC1, SERPINB1 MCL1 1685/4885RXFP1 947/4885KDM4E 4490/4885
US-20220340665-A1 INHIBITOR AGAINST EXPRESSION OF IMMUNE CHECKPOINT MOLECULE SERPINE1, CD274, PDCD1 MCL1 81/4885RXFP1 1477/4885KDM4E 2291/4885
US-10092537-B2 Use for PAI-1 inhibitor SERPINE1, SERPINC1, SERPINB1 MCL1 21/4885RXFP1 3510/4885KDM4E 4348/4885

“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.