SCHEMBL27520163

SCHEMBL27520163

Cc1cc(C(=O)O)c(-c2ccc(F)c(Cl)c2)c(C(=O)O)c1

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
RPA1 P27694 1/20 0.49
DHODH Q02127 4/20 0.48
AKR1C2 P52895 2/20 0.48
AKR1C1 Q04828 2/20 0.48
KMO O15229 2/20 0.47
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
MEN1 O00255 1/20 0.43
LMNA P02545 1/20 0.43
HTT P42858 1/20 0.43
KMT2A Q03164 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
CASP1 P29466 1/20 0.43
FTO Q9C0B1 2/20 0.42
PTGS2 P35354 1/20 0.42
MDM2 Q00987 2/20 0.41
TTR P02766 1/20 0.41
IDO1 P14902 1/20 0.41
TDO2 P48775 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
SCHEMBL27517441 0.82 NPC1 (0.54) DHODHAKR1C2AKR1C1NPC1RAB9A
SCHEMBL27498799 0.78 DHODH (0.56) DHODHMEN1LMNAKMT2ATTR
SCHEMBL16608990 0.77 RPA1 (0.58) RPA1DHODHKMOSMN1; SMN2CASP1
SCHEMBL27709822 0.75 ALDH1A1 (0.47) DHODHAKR1C2KMOSMN1; SMN2CASP1
SCHEMBL11695681 0.75 AKR1C2 (0.58) RPA1AKR1C2AKR1C1KMO
SCHEMBL27631357 0.74 DHODH (0.58) DHODHKMOTTR
SCHEMBL3979148 0.74 ACMSD (0.59) RPA1KMOMEN1LMNAKMT2A
SCHEMBL19730792 0.74 RARB (0.48) DHODH
SCHEMBL24524864 0.74 SLC1A3 (0.40) RPA1AKR1C2KMOCASP1PTGS2
SCHEMBL31161066 0.73 CHRM1 (0.53) RPA1DHODHAKR1C2AKR1C1KMO

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-1228327-C Carboxylic acid derivatives and drugs containing the same EISAI CO LTD (JP) 2005-11-23 CN disclosed
CN-1377336-A Carboxylic acid derivatives and drugs containing the same EISAI CO LTD (JP) 2002-10-30 CN disclosed