SCHEMBL29010077

SCHEMBL29010077

O=C(O)CCc1cc(C(F)(F)F)cnc1Cl

nearest known ligand 0.66

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 2/20 0.66
GAA P10253 3/20 0.47
KDM4E B2RXH2 1/20 0.47
AGBL2 Q5U5Z8 1/20 0.47
ALDH1A1 P00352 4/20 0.44
GLA P06280 2/20 0.43
HPGD P15428 1/20 0.43
SMN1; SMN2 Q16637 2/20 0.42
PLAU P00749 1/20 0.42
FFAR4 Q5NUL3 1/20 0.40
RXRA P19793 1/20 0.39
RXRB P28702 1/20 0.39
RXRG P48443 1/20 0.39
GPR17 Q13304 1/20 0.39

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
SCHEMBL20303792 0.81 FFAR1 (0.48) FFAR1GAAKDM4EAGBL2ALDH1A1
SCHEMBL29009906 0.80 PLAU (0.44) FFAR1AGBL2PLAUFFAR4GPR17
SCHEMBL5717719 0.79 MAPT (0.58) FFAR1GAAKDM4EAGBL2ALDH1A1
SCHEMBL3219363 0.77 ALDH1A1 (0.47) FFAR1GAAKDM4EAGBL2ALDH1A1
SCHEMBL30636546 0.77 ALDH1A1 (0.47) FFAR1GAAKDM4EAGBL2ALDH1A1
SCHEMBL22775190 0.75 FFAR1 (0.47) FFAR1GAAKDM4EAGBL2ALDH1A1
SCHEMBL3222684 0.75 FFAR1 (0.45) FFAR1GAAKDM4EAGBL2ALDH1A1
SCHEMBL29841878 0.75 FFAR1 (0.45) FFAR1GAAKDM4EAGBL2ALDH1A1
SCHEMBL31750436 0.75 FFAR1 (0.54) FFAR1ALDH1A1FFAR4
Azelaic Acid SCHEMBL27562613 0.74 MAPT (0.57) FFAR1GAAKDM4EAGBL2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116209433-B Small molecule albumin binding agents 俄勒冈健康科学大学 2025-05-23 CN disclosed
CN-116209433-A Small molecule albumin binding agents 俄勒冈健康科学大学 2023-06-02 CN disclosed