SCHEMBL11354558

SCHEMBL11354558

CC(C)c1ccc(COO)cc1

nearest known ligand 0.63

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.63
RXRA P19793 1/20 0.50
RXRB P28702 1/20 0.50
NPC1 O15118 4/20 0.42
RAB9A P51151 4/20 0.42
NFE2L2 Q16236 1/20 0.42
KDM4E B2RXH2 1/20 0.42
POLB P06746 1/20 0.42
ESR1 P03372 1/20 0.42
ESR2 Q92731 1/20 0.42
ALOX5 P09917 1/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
HRH3 Q9Y5N1 1/20 0.40
ALDH1A1 P00352 2/20 0.39
KMT2A Q03164 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
PYCR1 P32322 1/20 0.39
HTT P42858 1/20 0.39
TYR P14679 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
SCHEMBL2293769 0.81 IDO1 (0.68) IDO1RXRARXRBNPC1RAB9A
SCHEMBL11341386 0.81 IDO1 (0.68) IDO1RXRARXRBNPC1RAB9A
SCHEMBL764954 0.79 IDO1 (0.65) IDO1RXRARXRBNPC1RAB9A
SCHEMBL10587274 0.78 IDO1 (0.48) IDO1RXRARXRBNPC1RAB9A
SCHEMBL17037240 0.77 IDO1 (0.63) IDO1RXRARXRBNPC1RAB9A
SCHEMBL2096474 0.77 IDO1 (0.63) IDO1RXRARXRBNPC1RAB9A
SCHEMBL1715484 0.77 IDO1 (1.00) IDO1
SCHEMBL19215657 0.77 IDO1 (0.63) IDO1RXRARXRBNPC1RAB9A
SCHEMBL260335 0.77 IDO1 (0.63) IDO1RXRARXRBNPC1RAB9A
SCHEMBL19121843 0.77 IDO1 (0.63) IDO1RXRARXRBNPC1RAB9A

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
JP-56007730-A None JP disclosed
US-20240136567-A1 ORGANIC-INORGANIC COMPOSITE SOLID POLYMER ELECTROLYTE, INTEGRATED ELECTRODE STRUCTURE AND ELECTROCHEMICAL ELEMENT INCLUDING SAME, AND METHOD FOR PRODUCING ORGANIC-INORGANIC COMPOSITE SOLID POLYMER ELECTROLYTE GRINERGY CO. LTD. (KR) 2024-04-25 US disclosed
CN-108273478-B Formaldehyde removal composition and product 李怀玉 2021-03-02 CN disclosed
CN-108273478-A A kind of formaldehyde removing composition and product 李怀玉 2018-07-13 CN disclosed
JP-S567730-A PREPARATION OF PHENOL MITSUBISHI GAS CHEM CO INC 1981-01-27 JP disclosed
US-3948995-A Process for converting alkylaromatic hydroperoxides into phenolic products and carbonyl products RHONE-POULENC-TEXTILE (FR) 1976-04-06 US disclosed