Zerencotrep

Zerencotrep

SCHEMBL16027694

Cn1c(=O)n(CCCO)c(=O)c2c1nc(Oc1cccc(OC(F)(F)F)c1)n2Cc1ccc(Cl)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TRPC5 Q9UL62 12/20 1.00
TRPC4 Q9UBN4 2/20 1.00
TRPC1 P48995 1/20 1.00
KCNH2 Q12809 1/20 0.81
TSHR P16473 3/20 0.53
PCSK9 Q8NBP7 1/20 0.52
P2RX3 P56373 1/20 0.49
MEN1 O00255 2/20 0.48
ALDH1A1 P00352 2/20 0.48
KMT2A Q03164 2/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
HIF1A Q16665 1/20 0.48

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
SCHEMBL16028598 0.98 TRPC5 (0.95) TRPC5TRPC4TRPC1KCNH2TSHR
SCHEMBL16028243 0.97 TRPC5 (0.94) TRPC5TRPC4TRPC1KCNH2TSHR
SCHEMBL16029036 0.95 TRPC5 (0.91) TRPC5TRPC4TRPC1KCNH2TSHR
SCHEMBL16363508 0.94 TRPC5 (0.89) TRPC5TRPC4TRPC1KCNH2TSHR
SCHEMBL16028242 0.93 TRPC5 (0.88) TRPC5TRPC4TRPC1KCNH2TSHR
SCHEMBL16027988 0.93 TRPC5 (0.88) TRPC5TRPC4TRPC1KCNH2TSHR
SCHEMBL16027656 0.93 TRPC5 (0.88) TRPC5TRPC4TRPC1KCNH2TSHR
SCHEMBL16028620 0.93 TRPC5 (0.88) TRPC5TRPC4TRPC1KCNH2TSHR
SCHEMBL16028439 0.93 TRPC5 (0.86) TRPC5TRPC4TRPC1KCNH2TSHR
SCHEMBL16076122 0.93 TRPC5 (0.86) TRPC5TRPC4TRPC1KCNH2TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4661847-A1 PHARMACEUTICAL COMPOSITION COMPRISING 7-(4-CHLOROBENZYL)-1-(3-HYDROXYPROPYL)-3-METHYL-8-(3-(TRIFLUOROMETHOXY)-PHENOXY)-3,7-DIHYDRO-1H-PURINE-2,6-DIONE Boehringer Ingelheim International GmbH (DE) 2025-12-17 EP claimed
WO-2024236027-A1 7-(4-CHLOROBENZYL)-1-(3-HYDROXYPROPYL)-3-METHYL-8-(3-(TRIFLUOROMETHOXY)-PHENOXY)-3,7-DIHYDRO-1H-PURINE-2,6-DIONE FOR USE IN THE TREATMENT OF BORDERLINE PERSONALITY DISORDER BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2024-11-21 WO claimed
WO-2024165540-A1 PHARMACEUTICAL COMPOSITION COMPRISING 7-(4-CHLOROBENZYL)-1-(3-HYDROXYPROPYL)-3-METHYL-8-(3-(TRIFLUOROMETHOXY)-PHENOXY)-3,7-DIHYDRO-1H-PURINE-2,6-DIONE BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2024-08-15 WO claimed
US-9969736-B2 Substituted xanthines and methods of use thereof HYDRA BIOSCIENCES, INC. (US) 2018-05-15 US claimed
US-20170305910-A1 Substituted Xanthines and Methods of Use Thereof BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2017-10-26 US claimed
US-12624041-B2 Heterocyclic compound and use thereof WUHAN LL SCIENCE AND TECHNOLOGY DEVELOPMENT CO., LTD. (CN) 2026-05-12 US disclosed
EP-4661847-A1 PHARMACEUTICAL COMPOSITION COMPRISING 7-(4-CHLOROBENZYL)-1-(3-HYDROXYPROPYL)-3-METHYL-8-(3-(TRIFLUOROMETHOXY)-PHENOXY)-3,7-DIHYDRO-1H-PURINE-2,6-DIONE Boehringer Ingelheim International GmbH (DE) 2025-12-17 EP disclosed
EP-4661847-A1 PHARMACEUTICAL COMPOSITION COMPRISING 7-(4-CHLOROBENZYL)-1-(3-HYDROXYPROPYL)-3-METHYL-8-(3-(TRIFLUOROMETHOXY)-PHENOXY)-3,7-DIHYDRO-1H-PURINE-2,6-DIONE Boehringer Ingelheim International GmbH (DE) 2025-12-17 EP disclosed
EP-4661847-A1 PHARMACEUTICAL COMPOSITION COMPRISING 7-(4-CHLOROBENZYL)-1-(3-HYDROXYPROPYL)-3-METHYL-8-(3-(TRIFLUOROMETHOXY)-PHENOXY)-3,7-DIHYDRO-1H-PURINE-2,6-DIONE Boehringer Ingelheim International GmbH (DE) 2025-12-17 EP disclosed
EP-4638452-A1 PROCESS FOR THE PREPARATION OF 7-(4-CHLOROBENZYL)-1-(3-HYDROXYPROPYL)-3-METHYL-8-(3-(TRIFLUOROMETHOXY)-PHENOXY)-3,7-DIHYDRO-1H-PURINE-2,6-DIONE Boehringer Ingelheim International GmbH (DE) 2025-10-29 EP disclosed
EP-4638452-A1 PROCESS FOR THE PREPARATION OF 7-(4-CHLOROBENZYL)-1-(3-HYDROXYPROPYL)-3-METHYL-8-(3-(TRIFLUOROMETHOXY)-PHENOXY)-3,7-DIHYDRO-1H-PURINE-2,6-DIONE Boehringer Ingelheim International GmbH (DE) 2025-10-29 EP disclosed
EP-4638452-A1 PROCESS FOR THE PREPARATION OF 7-(4-CHLOROBENZYL)-1-(3-HYDROXYPROPYL)-3-METHYL-8-(3-(TRIFLUOROMETHOXY)-PHENOXY)-3,7-DIHYDRO-1H-PURINE-2,6-DIONE Boehringer Ingelheim International GmbH (DE) 2025-10-29 EP disclosed
EP-2970303-A2 SUBSTITUTED XANTHINES AND METHODS OF USE THEREOF Hydra Biosciences, Inc. (US) 2016-01-20 EP disclosed
WO-2014143799-A9 SUBSTITUTED XANTHINES AND METHODS OF USE THEREOF HYDRA BIOSCIENCES, INC. (US) 2014-12-24 WO disclosed
WO-2014143799-A9 SUBSTITUTED XANTHINES AND METHODS OF USE THEREOF HYDRA BIOSCIENCES, INC. (US) 2014-12-24 WO disclosed
WO-2014143799-A2 SUBSTITUTED XANTHINES AND METHODS OF USE THEREOF HYDRA BIOSCIENCES, INC. (US) 2014-09-18 WO disclosed
WO-2014143799-A2 SUBSTITUTED XANTHINES AND METHODS OF USE THEREOF HYDRA BIOSCIENCES, INC. (US) 2014-09-18 WO disclosed
US-20140275071-A1 SUBSTITUTED XANTHINES AND METHODS OF USE THEREOF HYDRA BIOSCIENCES, INC. (US) 2014-09-18 US disclosed
US-20140275071-A1 SUBSTITUTED XANTHINES AND METHODS OF USE THEREOF HYDRA BIOSCIENCES, INC. (US) 2014-09-18 US disclosed
US-20140275071-A1 SUBSTITUTED XANTHINES AND METHODS OF USE THEREOF HYDRA BIOSCIENCES, INC. (US) 2014-09-18 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 (3 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-12624041-B2 Heterocyclic compound and use thereof TRPC1, TRPC5, TRPC3 TRPC5 2/4885TRPC4 7/4885TRPC1 1/4885
US-20170305910-A1 Substituted Xanthines and Methods of Use Thereof TRPC5, TRPC7, TRPC4 TRPC5 1/4885TRPC4 3/4885TRPC1 4/4885
US-20140275071-A1 SUBSTITUTED XANTHINES AND METHODS OF USE THEREOF TRPC5, TRPC7, TRPC4 TRPC5 1/4885TRPC4 3/4885TRPC1 4/4885

“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.