SCHEMBL30151169

SCHEMBL30151169

Cc1cc(CCC(=O)O)cc(C(F)(F)F)c1

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 7/20 0.48
THRA P10827 1/20 0.47
THRB P10828 1/20 0.47
FFAR1 O14842 9/20 0.47
LMNA P02545 1/20 0.44
FFAR2 O15552 1/20 0.43
TACR1 P25103 1/20 0.43
RXRA P19793 1/20 0.42
RXRB P28702 1/20 0.42
RXRG P48443 1/20 0.42
GPR17 Q13304 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
PPARA Q07869 1/20 0.41

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
SCHEMBL1015795 0.88 LMNA (0.54) FFAR4THRATHRBFFAR1LMNA
Trifluoroacetic Acid SCHEMBL30151164 0.84 TACR1 (0.40) FFAR4THRATHRBFFAR1FFAR2
SCHEMBL29927941 0.83 RXRA (0.54) FFAR4TACR1RXRARXRBRXRG
SCHEMBL17147284 0.83 RXRA (0.54) FFAR4TACR1RXRARXRBRXRG
SCHEMBL18255658 0.83 FFAR1 (0.50) FFAR4THRATHRBFFAR1LMNA
SCHEMBL5846204 0.82 FFAR1 (0.61) FFAR4THRATHRBFFAR1RXRA
SCHEMBL17310946 0.81 RXRA (0.51) FFAR4THRATHRBFFAR1LMNA
SCHEMBL30151149 0.80 THRA (0.50) FFAR4THRATHRBFFAR1LMNA
SCHEMBL30151135 0.80 THRA (0.47) FFAR4THRATHRBFFAR1LMNA
SCHEMBL14441580 0.80 RXRA (0.56) FFAR4THRATHRBFFAR1FFAR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115551846-B 1,4,5, 6-tetrahydropyrimidin-2-amine derivatives UBE株式会社 2024-03-08 CN claimed
WO-2023085396-A1 PHARMACEUTICAL COMPOSITION FOR PROVIDING TREATMENT FOR OR PREVENTING ALPORT SYNDROME UBE株式会社 2023-05-19 WO claimed
CN-115551846-A 1,4,5,6-tetrahydropyrimidin-2-amine derivatives UBE株式会社 2022-12-30 CN claimed
CN-115551846-B 1,4,5, 6-tetrahydropyrimidin-2-amine derivatives UBE株式会社 2024-03-08 CN disclosed
WO-2023085396-A1 PHARMACEUTICAL COMPOSITION FOR PROVIDING TREATMENT FOR OR PREVENTING ALPORT SYNDROME UBE株式会社 2023-05-19 WO disclosed
CN-115551846-A 1,4,5,6-tetrahydropyrimidin-2-amine derivatives UBE株式会社 2022-12-30 CN disclosed