SCHEMBL8059639

SCHEMBL8059639

O=C(O)c1ccc(Oc2ccccc2)c(C(F)(F)F)c1

nearest known ligand 0.62

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TTR P02766 2/20 0.62
AKR1C3 P42330 1/20 0.51
LPAR1 Q92633 1/20 0.48
LPAR5 Q9H1C0 1/20 0.48
STK39 Q9UEW8 1/20 0.48
SRD5A2 P31213 2/20 0.47
EGLN1 Q9GZT9 1/20 0.47
MRGPRX4 Q96LA9 5/20 0.47
RXRA P19793 2/20 0.47
RXRB P28702 2/20 0.47
RXRG P48443 2/20 0.47
RAF1 P04049 1/20 0.46
SCN9A Q15858 1/20 0.45
NR1H4 Q96RI1 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
SCHEMBL8075068 0.85 NOTUM (0.54) TTRSTK39MRGPRX4RAF1SCN9A
SCHEMBL8059420 0.83 PLA2G7 (0.45) TTRLPAR1LPAR5SRD5A2MRGPRX4
SCHEMBL8068494 0.82 PLA2G7 (0.46) TTRLPAR1LPAR5SRD5A2EGLN1
SCHEMBL9788489 0.82 MRGPRX4 (0.61) TTRAKR1C3LPAR1LPAR5MRGPRX4
SCHEMBL10670283 0.81 RXRA (0.54) AKR1C3SRD5A2MRGPRX4RXRARXRB
SCHEMBL16319437 0.81 KMO (0.56) TTREGLN1MRGPRX4RXRARXRB
Hydrochloric Acid SCHEMBL8503964 0.81 SLC9A1 (0.49)
SCHEMBL8068456 0.80 TTR (0.44) TTRLPAR1LPAR5SRD5A2MRGPRX4
SCHEMBL30835355 0.80 RXRA (0.46) TTRMRGPRX4RXRARXRBRXRG
SCHEMBL11462504 0.80 TTR (0.81) TTRAKR1C3SRD5A2MRGPRX4NR1H4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111868055-B Inhibitors of TRPC6 勃林格殷格翰国际有限公司 2024-03-08 CN disclosed
US-11370771-B2 Inhibitors of TRPC6 BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2022-06-28 US disclosed
US-11370771-B2 Inhibitors of TRPC6 BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2022-06-28 US disclosed
US-20210053935-A1 INHIBITORS OF TRPC6 BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2021-02-25 US disclosed
US-20210053935-A1 INHIBITORS OF TRPC6 BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2021-02-25 US disclosed
EP-3752503-A1 INHIBITORS OF TRPC6 Boehringer Ingelheim International GmbH (DE) 2020-12-23 EP disclosed
CN-111868055-A Inhibitors of TRPC6 勃林格殷格翰国际有限公司 2020-10-30 CN disclosed
WO-2019161010-A1 INHIBITORS OF TRPC6 BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2019-08-22 WO disclosed
WO-2019161010-A1 INHIBITORS OF TRPC6 BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2019-08-22 WO disclosed
US-6057322-A USEFUL IN TREATMENT OF CARDIOVASCULAR DISEASES HOECHST AKTIENGESELLSCHAFT (DE) 2000-05-02 US disclosed
EP-0723956-B1 Basically substituted benzoylguanidines, process for their preparation, their use as medicaments or diagnostics as well as medicaments containing them HOECHST AG (DE) 1999-10-13 EP disclosed
EP-0723956-A1 Basically substituted benzoylguanidines, process for their preparation, their use as medicaments or diagnostics as well as medicaments containing them HOECHST AKTIENGESELLSCHAFT (DE) 1996-07-31 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 (2 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-20210053935-A1 INHIBITORS OF TRPC6 TRPC6, TRPC1, TRPC4 TTR 1641/4885AKR1C3 361/4885LPAR1 284/4885
US-11370771-B2 Inhibitors of TRPC6 TRPC6, TRPC1, TRPC4 TTR 1641/4885AKR1C3 361/4885LPAR1 284/4885

“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.