SCHEMBL29920728

SCHEMBL29920728

COc1cc2c(cc1OCCCCCC(=O)O)C[C@@H](C(C)C)n1cc(C(=O)O)c(=O)cc1-2

nearest known ligand 0.64

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CYP2B6 P20813 1/20 0.61
TENT4A Q5XG87 1/20 0.61
TENT4B Q8NDF8 1/20 0.61
HTR1A P08908 1/20 0.35
HTR2A P28223 1/20 0.35
HTR2C P28335 1/20 0.35
HTR7 P34969 1/20 0.35
HTR2B P41595 1/20 0.35
PPARA Q07869 1/20 0.35

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
SCHEMBL26699185 1.00 CYP2B6 (0.61) CYP2B6TENT4ATENT4BHTR1AHTR2A
SCHEMBL26699177 1.00 CYP2B6 (0.61) CYP2B6TENT4ATENT4BHTR1AHTR2A
SCHEMBL26699184 1.00 CYP2B6 (0.61) CYP2B6TENT4ATENT4BHTR1AHTR2A
SCHEMBL26699182 1.00 CYP2B6 (0.61) CYP2B6TENT4ATENT4BHTR1AHTR2A
SCHEMBL29920976 1.00 CYP2B6 (0.61) CYP2B6TENT4ATENT4BHTR1AHTR2A
SCHEMBL26699186 1.00 CYP2B6 (0.61) CYP2B6TENT4ATENT4BHTR1AHTR2A
SCHEMBL29920773 1.00 CYP2B6 (0.61) CYP2B6TENT4ATENT4BHTR1AHTR2A
SCHEMBL26699176 1.00 CYP2B6 (0.61) CYP2B6TENT4ATENT4BHTR1AHTR2A
SCHEMBL29920711 1.00 CYP2B6 (0.61) CYP2B6TENT4ATENT4BHTR1AHTR2A
SCHEMBL26699181 1.00 CYP2B6 (0.61) CYP2B6TENT4ATENT4BHTR1AHTR2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4320117-A2 NOVEL HEPATOSELECTIVE POLYADENYLATING POLYMERASES INHIBITORS AND THEIR METHOD OF USE Baruch S. Blumberg Institute (US) 2024-02-14 EP claimed
CN-117279909-A Novel liver selective polyadenylation polymerase inhibitors and methods of use thereof 巴鲁克斯布伦博格研究所 2023-12-22 CN claimed
WO-2023230249-A1 NOVEL HEPATOSELECTIVE POLYADENYLATING POLYMERASES INHIBITORS AND THEIR METHOD OF USE BARUCH S. BLUMBERG INSTITUTE (US) 2023-11-30 WO claimed
WO-2022216552-A2 NOVEL HEPATOSELECTIVE POLYADENYLATING POLYMERASES INHIBITORS AND THEIR METHOD OF USE BARUCH S. BLUMBERG INSTITUTE (US) 2022-10-13 WO claimed
EP-4320117-A2 NOVEL HEPATOSELECTIVE POLYADENYLATING POLYMERASES INHIBITORS AND THEIR METHOD OF USE Baruch S. Blumberg Institute (US) 2024-02-14 EP disclosed
CN-117279909-A Novel liver selective polyadenylation polymerase inhibitors and methods of use thereof 巴鲁克斯布伦博格研究所 2023-12-22 CN disclosed
WO-2023230249-A1 NOVEL HEPATOSELECTIVE POLYADENYLATING POLYMERASES INHIBITORS AND THEIR METHOD OF USE BARUCH S. BLUMBERG INSTITUTE (US) 2023-11-30 WO disclosed
WO-2022216552-A2 NOVEL HEPATOSELECTIVE POLYADENYLATING POLYMERASES INHIBITORS AND THEIR METHOD OF USE BARUCH S. BLUMBERG INSTITUTE (US) 2022-10-13 WO disclosed