SCHEMBL29104693

SCHEMBL29104693

Cc1oc2cc(F)c(O)cc2c1C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.46
HTT P42858 2/20 0.46
GPR35 Q9HC97 1/20 0.45
SLC26A4 O43511 7/20 0.41
ALDH1A1 P00352 2/20 0.41
HPGD P15428 2/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
KMT2A Q03164 6/20 0.40
MEN1 O00255 5/20 0.40
BLM P54132 1/20 0.40
ATM Q13315 1/20 0.40
POLB P06746 3/20 0.39
MCL1 Q07820 2/20 0.39
PTPN5 P54829 1/20 0.39
CASP6 P55212 1/20 0.39
BCL2L1 Q07817 1/20 0.39
CTDSP1 Q9GZU7 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
GAA P10253 2/20 0.38

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
SCHEMBL7825883 0.81 MAPT (0.55) LMNAHTTALDH1A1KMT2AMEN1
SCHEMBL17912486 0.81 MEN1 (0.51) LMNAHTTGPR35SLC26A4ALDH1A1
SCHEMBL17912483 0.81 EYA3 (0.48) LMNAHTTGPR35SLC26A4ALDH1A1
SCHEMBL10938750 0.75 GPR35 (0.54) HTTGPR35ALDH1A1HPGDRAB9A
SCHEMBL15020090 0.75 LMNA (0.64) LMNAHTTSLC26A4SMN1; SMN2KMT2A
SCHEMBL16654658 0.75 PTGS2 (0.47) LMNAHTTGPR35SLC26A4ALDH1A1
SCHEMBL31604869 0.75 SLC26A4 (0.43) LMNAHTTSLC26A4SMN1; SMN2KMT2A
Hydrochloric Acid SCHEMBL11133623 0.74 GPR35 (0.53) HTTGPR35ALDH1A1HPGDRAB9A
SCHEMBL24470616 0.73 HTT (0.64) LMNAHTTSLC26A4ALDH1A1HPGD
SCHEMBL2083566 0.73 ALDH1A1 (0.54) LMNAHTTALDH1A1HPGDSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116761796-A Aryl derivatives for the treatment of TRPM3 mediated disorders 勒芬天主教大学 2023-09-15 CN disclosed