SCHEMBL277722

SCHEMBL277722

[c]1cncc2ncccc12

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.38
▸ KDM4E B2RXH2 2/20 0.38
▸ ALDH1A1 P00352 6/20 0.37
▸ CYP2A6 P11509 3/20 0.33
▸ NPC1 O15118 4/20 0.32
▸ POLB P06746 1/20 0.32
▸ RAB9A P51151 1/20 0.32
▸ CYP3A4 P08684 2/20 0.31
▸ HTT P42858 3/20 0.31
▸ HSP90AA1 P07900 3/20 0.31
▸ MEN1 O00255 2/20 0.31
▸ CASP1 P29466 2/20 0.31
▸ KMT2A Q03164 2/20 0.31
▸ LMNA P02545 2/20 0.31
▸ HSP90AB1 P08238 2/20 0.31
▸ CYP1A2 P05177 2/20 0.31
▸ CASP7 P55210 1/20 0.31
▸ CYP2C19 P33261 1/20 0.31
▸ NR4A2 P43354 1/20 0.31
▸ BLM P54132 1/20 0.31

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
SCHEMBL23980 0.76 MAPT (0.55) MAPTKDM4EALDH1A1NPC1POLB
SCHEMBL3934900 0.71 — —
SCHEMBL18594 0.70 ALDH1A1 (0.44) MAPTKDM4EALDH1A1NPC1POLB
SCHEMBL16317 0.68 KDM4A (0.32) —
SCHEMBL17511979 0.67 CYP3A4 (0.49) MAPTKDM4EALDH1A1NPC1POLB
SCHEMBL23226 0.67 CCR1 (0.48) MAPTKDM4EALDH1A1NPC1CYP3A4
SCHEMBL9436 0.67 EGFR (0.37) CYP2A6
SCHEMBL3936319 0.67 — —
SCHEMBL450508 0.67 MAPT (0.38) MAPTKDM4EALDH1A1NPC1POLB
SCHEMBL276736 0.67 KDM4E (0.38) MAPTKDM4EALDH1A1CYP2A6NPC1

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 115 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3558969-A1 PYRAZOLE DERIVATIVES AS MALT1 INHIBITORS Janssen Pharmaceutica NV (BE) 2019-10-30 — — EP claimed
WO-2018119036-A1 PYRAZOLE DERIVATIVES AS MALT1 INHIBITORS JANSSEN BIOTECH, INC. (US) 2018-06-28 — — WO claimed
US-20180170909-A1 PYRAZOLE DERIVATIVES AS MALT1 INHIBITORS JANSSEN-CILAG (FR) 2018-06-21 — — US claimed
CN-113473971-B Pharmaceutical formulations 詹森药业有限公司 2024-07-02 — — CN disclosed
US-20230310413-A1 PHARMACEUTICAL FORMULATIONS COMPRISING A MALT1 INHIBITOR AND A MIXTURE OF POLYETHYLENE GLYCOL WITH A FATTY ACID JANSSEN PHARMACEUTICA NV (BE) 2023-10-05 — — US disclosed
CN-115884773-A Pharmaceutical preparation 詹森药业有限公司 2023-03-31 — — CN disclosed
US-11548910-B2 Oligonucleotide production method NISSAN CHEMICAL CORPORATION (JP) 2023-01-10 — — US disclosed
US-20220175760-A1 PHARMACEUTICAL FORMULATIONS JANSSEN PHARMACEUTICA NV (BE) 2022-06-09 — — US disclosed
EP-3927324-A1 PHARMACEUTICAL FORMULATIONS Janssen Pharmaceutica NV (BE) 2021-12-29 — — EP disclosed
CN-113473971-A Pharmaceutical formulations 詹森药业有限公司 2021-10-01 — — CN disclosed
US-10954214-B2 Pyrazole derivatives as MALT1 inhibitors JANSSEN PHARMACEUTICA NV (BE) 2021-03-23 — — US disclosed
WO-2005090357-A1 TRICYCLIC BENZOPYRAN COMPOUND AS ANTI-ARRHYTHMIC AGENTS NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2005-09-29 — — WO disclosed
WO-2005080368-A2 BENZOPYRAN COMPOUND USEFUL FOR THE TREATMENT OF ARRHYTMIA NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2005-09-01 — — WO disclosed
EP-1549618-A1 PYRAZOLONE COMPOUNDS AS THROMBOPOIETIN RECEPTOR ACTIVATORS Nissan Chemical Industries, Ltd. (JP) 2005-07-06 — — EP disclosed
WO-2004108683-A1 3-ALKYLIDENEHYDRAZINO SUBSTITUTED HETEROARYL COMPOUNDS AS THROMBOPOIETIN RECEPTOR ACTIVATORS NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2004-12-16 — — WO disclosed
WO-2004033433-A1 PYRAZOLONE COMPOUNDS AND THROMBOPOIETIN RECEPTOR ACTIVATOR NISSAN CHEMICAL INDUSTRIES, LTD. (JP) 2004-04-22 — — WO disclosed
US-5280009-A Herbicide BASF AKTIENGESELLSCHAFT (DE) 1994-01-18 — — US disclosed
EP-0247381-B1 5-FLUROROURACIL DERIVATIVES OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1993-08-04 — — EP disclosed
US-5047521-A Anticarcinogenic agents OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1991-09-10 — — US disclosed
EP-0247381-A2 5-flurorouracil derivatives OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1987-12-02 — — 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-10954214-B2 Pyrazole derivatives as MALT1 inhibitors MALT1, PPP3R1, SQSTM1 MAPT 2314/4885KDM4E 3526/4885ALDH1A1 2543/4885
US-11548910-B2 Oligonucleotide production method RNGTT, OSGEP, PHAX MAPT 3183/4885KDM4E 3898/4885ALDH1A1 3610/4885
US-20230310413-A1 PHARMACEUTICAL FORMULATIONS COMPRISING A MALT1 INHIBITOR AND A MIXTURE OF POLYETHYLENE GLYCOL WITH A FATTY ACID MALT1, MGAM, MGLL MAPT 887/4885KDM4E 1704/4885ALDH1A1 2560/4885
US-20220175760-A1 PHARMACEUTICAL FORMULATIONS TREH, F12, CEL MAPT 62/4885KDM4E 2572/4885ALDH1A1 2990/4885
US-20180170909-A1 PYRAZOLE DERIVATIVES AS MALT1 INHIBITORS MALT1, PPP3R1, SQSTM1 MAPT 2314/4885KDM4E 3526/4885ALDH1A1 2543/4885

“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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