SCHEMBL16341808

SCHEMBL16341808

COc1ccc(Cn2nc(C(=O)Nc3ccccc3C)c(=O)c3ccccc32)cc1

nearest known ligand 0.57

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ PTGER4 P35408 3/20 0.57
▸ P2RX4 Q99571 1/20 0.52
▸ KMT2A Q03164 2/20 0.51
▸ MEN1 O00255 1/20 0.51
▸ CNR1 P21554 1/20 0.49
▸ CNR2 P34972 1/20 0.49
▸ SMN1; SMN2 Q16637 4/20 0.48
▸ CYP1A2 P05177 1/20 0.48
▸ HDAC1 Q13547 2/20 0.48
▸ CHRM1 P11229 1/20 0.47
▸ MAPT P10636 2/20 0.46
▸ POLB P06746 2/20 0.46
▸ ALDH1A1 P00352 2/20 0.46
▸ KDM4E B2RXH2 1/20 0.46
▸ HTT P42858 1/20 0.46
▸ BLM P54132 1/20 0.45
▸ L3MBTL1 Q9Y468 2/20 0.44
▸ ALOX15 P16050 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
SCHEMBL16341256 0.89 PTGER4 (0.56) PTGER4P2RX4CNR1CNR2SMN1; SMN2
SCHEMBL16340925 0.87 PTGER4 (0.63) PTGER4P2RX4KMT2AMEN1CNR1
SCHEMBL16341865 0.83 PTGER4 (0.66) PTGER4P2RX4CNR1CNR2SMN1; SMN2
SCHEMBL16341199 0.82 PTGER4 (0.55) PTGER4P2RX4CNR1CNR2HDAC1
SCHEMBL16341822 0.82 PTGER4 (0.64) PTGER4P2RX4KMT2AMEN1CNR1
SCHEMBL16377892 0.81 PTGER4 (0.56) PTGER4P2RX4KMT2AMEN1CNR1
SCHEMBL16341191 0.80 PTGER4 (0.62) PTGER4P2RX4KMT2AMEN1CNR1
SCHEMBL22416146 0.80 PTGER4 (0.62) PTGER4P2RX4KMT2AMEN1CNR1
SCHEMBL16340929 0.80 CHRM1 (0.69) SMN1; SMN2CHRM1POLBALDH1A1
SCHEMBL16341433 0.80 PTGER4 (0.62) PTGER4P2RX4KMT2AMEN1CNR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2821401-B1 DIHYDROQUINOLINONE COMPOUNDS AS MODULATORS OF THE MUSCARININC M1 RECEPTOR TAKEDA PHARMACEUTICALS CO (JP) 2020-09-09 — — EP disclosed
EP-2821401-B1 DIHYDROQUINOLINONE COMPOUNDS AS MODULATORS OF THE MUSCARININC M1 RECEPTOR TAKEDA PHARMACEUTICALS CO (JP) 2020-09-09 — — EP disclosed
US-9403802-B2 Heterocyclic compound and use therefor TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2016-08-02 — — US disclosed
US-9403802-B2 Heterocyclic compound and use therefor TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2016-08-02 — — US disclosed
US-9403802-B2 Heterocyclic compound and use therefor TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2016-08-02 — — US disclosed
US-20150126487-A1 HETEROCYCLIC COMPOUND AND USE THEREFOR TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2015-05-07 — — US disclosed
US-20150126487-A1 HETEROCYCLIC COMPOUND AND USE THEREFOR TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2015-05-07 — — US disclosed
US-20150126487-A1 HETEROCYCLIC COMPOUND AND USE THEREFOR TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2015-05-07 — — US disclosed
EP-2821401-A1 HETEROCYCLIC COMPOUND AND USE THEREFOR Takeda Pharmaceutical Company Limited (JP) 2015-01-07 — — EP disclosed
EP-2821401-A1 HETEROCYCLIC COMPOUND AND USE THEREFOR Takeda Pharmaceutical Company Limited (JP) 2015-01-07 — — 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 (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-20150126487-A1 HETEROCYCLIC COMPOUND AND USE THEREFOR CHRM1, CHRM4, CHRM2 PTGER4 629/4885P2RX4 395/4885KMT2A 1040/4885

“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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