SCHEMBL27618293

SCHEMBL27618293

O=C(O)c1ccc(F)c(Cl)c1.O=C(O)c1ccc(F)cc1Cl

nearest known ligand 0.56

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PYGL P06737 7/20 0.56
TSHR P16473 2/20 0.51
CASP1 P29466 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
SRD5A2 P31213 1/20 0.46
HPGD P15428 1/20 0.43
HSD11B1 P28845 1/20 0.42
KCNQ3 O43525 1/20 0.42
KCNQ2 O43526 1/20 0.42
KCNE1 P15382 1/20 0.42
KCNQ1 P51787 1/20 0.42
KEAP1 Q14145 1/20 0.41
MRGPRX4 Q96LA9 1/20 0.41
MDM4 O15151 1/20 0.41
MDM2 Q00987 1/20 0.41
BCL2L1 Q07817 1/20 0.41
BAD Q92934 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
SCHEMBL195310 0.85 TSHR (0.63) PYGLTSHRCASP1SMN1; SMN2HPGD
SCHEMBL30308290 0.85 TSHR (0.65) TSHRSMN1; SMN2SRD5A2KCNQ3KCNQ2
SCHEMBL109599 0.85 TSHR (0.65) TSHRSMN1; SMN2SRD5A2KCNQ3KCNQ2
Hydrochloric Acid SCHEMBL7105574 0.83 TSHR (0.63) TSHRSMN1; SMN2SRD5A2KCNQ3KCNQ2
SCHEMBL30162746 0.83 TSHR (0.68) PYGLTSHRCASP1SMN1; SMN2SRD5A2
SCHEMBL68294 0.83 TSHR (0.68) PYGLTSHRCASP1SMN1; SMN2SRD5A2
Hydrochloric Acid SCHEMBL943311 0.81 TSHR (0.65) PYGLTSHRCASP1SMN1; SMN2SRD5A2
Hydrochloric Acid SCHEMBL1681859 0.81 TSHR (0.65) PYGLTSHRCASP1SMN1; SMN2SRD5A2
SCHEMBL27618291 0.79 HPGD (0.43) PYGLHPGDHSD11B1KCNQ3KCNQ2
SCHEMBL21518146 0.78 PYGL (0.40) PYGLSMN1; SMN2HPGDHSD11B1KCNQ3

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-1724532-A Colorant compound XEROX CORP (US) 2006-01-25 CN disclosed