SCHEMBL29371850

SCHEMBL29371850

CC1(C)c2cc(C(=O)O)ccc2-c2ccc(C(=O)O)cc21

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RARB P10826 5/20 0.46
RARG P13631 5/20 0.46
RARA P10276 5/20 0.46
CYP26A1 O43174 2/20 0.46
CYP26B1 Q9NR63 1/20 0.46
RXRA P19793 5/20 0.46
RXRB P28702 5/20 0.46
RXRG P48443 3/20 0.46
SRD5A2 P31213 1/20 0.46
TTR P02766 1/20 0.46
ALK Q9UM73 1/20 0.45
PTPRC P08575 2/20 0.44
TDP1 Q9NUW8 1/20 0.44
TP53 P04637 1/20 0.44
TSHR P16473 1/20 0.44
CYP3A4 P08684 1/20 0.44
PDK2 Q15119 1/20 0.44
POLB P06746 2/20 0.43
KDM4E B2RXH2 1/20 0.43
CA12 O43570 1/20 0.43

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
SCHEMBL21439836 1.00 RARB (0.46) RARBRARGRARACYP26A1CYP26B1
Hydrochloric Acid SCHEMBL28484832 0.98 RARB (0.45) RARBRARGRARACYP26A1CYP26B1
SCHEMBL30340691 0.91 PDK2 (0.53) RARBRARGRXRASRD5A2TTR
SCHEMBL13269073 0.91 PDK2 (0.53) RARBRARGRXRASRD5A2TTR
SCHEMBL21333830 0.89 SRD5A2 (0.53) RARBRARGRARACYP26A1CYP26B1
SCHEMBL31146505 0.87 PDK2 (0.55) RARBRARGRARARXRARXRB
SCHEMBL28842566 0.86 PDK2 (0.46) RARBRARGRARACYP26A1CYP26B1
SCHEMBL15040998 0.83 MAPT (0.57) PDK2MAPTL3MBTL1ALDH1A1
SCHEMBL21760463 0.83 RXRA (0.41) RARBRARGRXRARXRBRXRG
SCHEMBL22859400 0.83 ALK (0.44) RARBRARGRARARXRARXRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109141635-B Imaging spectrometer and hyperspectral imaging method thereof 南京邮电大学 2023-12-12 CN disclosed
CN-109556716-B Imaging spectrometer based on diffraction effect and hyperspectral imaging method thereof 南京邮电大学 2022-03-15 CN disclosed
CN-109708756-B Imaging spectrometer based on diffraction effect and high spatial resolution spectral imaging method 南京邮电大学 2022-02-08 CN disclosed
CN-109708755-B Imaging spectrometer based on filtering effect and high spatial resolution spectral imaging method 南京邮电大学 2022-02-08 CN disclosed
CN-109708757-B Imaging spectrometer based on scattering effect and high spatial resolution spectral imaging method 南京邮电大学 2022-02-08 CN disclosed