SCHEMBL16341817

SCHEMBL16341817

COc1ccc(Cn2cc(C(=O)O)c(=O)c3c(F)ccc(F)c32)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 8/20 1.00
SMN1; SMN2 Q16637 1/20 0.54
LMNA P02545 2/20 0.47
ALDH1A1 P00352 2/20 0.46
KDM4E B2RXH2 1/20 0.46
HPGD P15428 1/20 0.46
TSHR P16473 1/20 0.46
RAB9A P51151 1/20 0.46
HSD17B10 Q99714 1/20 0.46
P2RX7 Q99572 1/20 0.45
THRB P10828 1/20 0.43

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
SCHEMBL2485404 0.97 CHRM1 (0.93) CHRM1SMN1; SMN2LMNA
SCHEMBL22416064 0.91 CHRM1 (0.83) CHRM1SMN1; SMN2LMNAALDH1A1KDM4E
SCHEMBL16341848 0.89 CHRM1 (0.81) CHRM1SMN1; SMN2LMNAP2RX7THRB
SCHEMBL2883197 0.88 CHRM1 (0.80) CHRM1SMN1; SMN2LMNA
SCHEMBL16341842 0.87 CHRM1 (0.78) CHRM1SMN1; SMN2LMNATHRB
SCHEMBL16341505 0.87 CHRM1 (0.78) CHRM1SMN1; SMN2LMNATHRB
SCHEMBL14413508 0.86 CHRM1 (0.78) CHRM1SMN1; SMN2LMNAALDH1A1
SCHEMBL2883219 0.86 CHRM1 (0.76) CHRM1LMNAALDH1A1KDM4EHPGD
SCHEMBL16378027 0.86 CHRM1 (0.76) CHRM1SMN1; SMN2ALDH1A1KDM4EP2RX7
SCHEMBL2880256 0.86 CHRM1 (0.76) CHRM1SMN1; SMN2LMNARAB9AP2RX7

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 CHRM1 1/4885SMN1; SMN2 2464/4885LMNA 4571/4885

“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.