SCHEMBL24690169

SCHEMBL24690169

N#Cc1cc(Cl)nc(Oc2ccccc2)c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 3/20 0.51
PIN1 Q13526 1/20 0.43
SMN1; SMN2 Q16637 6/20 0.43
LMNA P02545 3/20 0.43
HTT P42858 2/20 0.43
TDP1 Q9NUW8 2/20 0.41
MAPK1 P28482 2/20 0.41
MEN1 O00255 4/20 0.41
KMT2A Q03164 4/20 0.41
KDM4E B2RXH2 1/20 0.40
CYP1A2 P05177 2/20 0.40
CYP2C19 P33261 2/20 0.40
HPGD P15428 2/20 0.40
CHEK2 O96017 1/20 0.40
GLA P06280 1/20 0.40
POLB P06746 1/20 0.40
MAPT P10636 2/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
ADRB2 P07550 1/20 0.40
CYP2C9 P11712 1/20 0.40

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
SCHEMBL30020111 1.00 GRM5 (0.51) GRM5PIN1SMN1; SMN2LMNAHTT
SCHEMBL18049170 0.95 GRM5 (0.51) GRM5PIN1SMN1; SMN2LMNAHTT
SCHEMBL8773189 0.84 GRM5 (0.47) GRM5SMN1; SMN2LMNAMAPK1MEN1
SCHEMBL17609079 0.84 GRM5 (0.49) GRM5KDM4EHPGDMAPTL3MBTL1
SCHEMBL19402607 0.78 MAPK1 (0.47) SMN1; SMN2HTTTDP1MAPK1MEN1
SCHEMBL8773165 0.77 GRM5 (0.78) GRM5MEN1KMT2ANUDT1
SCHEMBL23504272 0.77 GRM5 (0.65) GRM5SMN1; SMN2LMNAHTT
SCHEMBL20239278 0.77 PGR (0.47) GRM5SMN1; SMN2LMNAMAPK1MEN1
SCHEMBL20239277 0.76 GRM5 (0.45) GRM5SMN1; SMN2LMNAHTTMEN1
SCHEMBL7071630 0.76 MAPK1 (0.48) GRM5LMNATDP1MAPK1MEN1

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
WO-2022224212-A1 GPR35 AGONIST COMPOUNDS HEPTARES THERAPEUTICS LIMITED (GB) 2022-10-27 WO disclosed