SCHEMBL24170197

SCHEMBL24170197

Cc1cc(Cl)c(NC(=O)c2ccccc2C)cc1Cl

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNMA1 Q12791 1/20 0.61
DHODH Q02127 1/20 0.60
CSF1R P07333 1/20 0.58
GRM4 Q14833 1/20 0.57
ALDH1A1 P00352 7/20 0.57
CYP2C9 P11712 1/20 0.56
RAB9A P51151 4/20 0.56
HPGD P15428 4/20 0.54
MEN1 O00255 1/20 0.53
KMT2A Q03164 1/20 0.53
NPC1 O15118 3/20 0.52
SMN1; SMN2 Q16637 2/20 0.52
LMNA P02545 3/20 0.52
POLB P06746 1/20 0.52
MAPT P10636 1/20 0.52
KDM4E B2RXH2 2/20 0.51
NPSR1 Q6W5P4 1/20 0.51
HTT P42858 2/20 0.50
MAPK1 P28482 1/20 0.50
HSD17B10 Q99714 1/20 0.50

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
SCHEMBL24170257 0.87 KCNMA1 (0.57) KCNMA1DHODHCSF1RGRM4ALDH1A1
SCHEMBL92226 0.84 RAB9A (0.57) ALDH1A1RAB9AMEN1KMT2ANPC1
SCHEMBL12225787 0.83 KCNMA1 (0.72) KCNMA1DHODHGRM4ALDH1A1RAB9A
SCHEMBL13164048 0.82 HPGD (0.74) KCNMA1DHODHCSF1RGRM4ALDH1A1
SCHEMBL7331410 0.80 GRM4 (0.59) KCNMA1DHODHGRM4ALDH1A1CYP2C9
SCHEMBL7332090 0.80 PYGL (0.62) KCNMA1DHODHGRM4ALDH1A1RAB9A
SCHEMBL92574 0.78 NPC1 (0.61) ALDH1A1RAB9AMEN1KMT2ANPC1
SCHEMBL11320747 0.78 ALDH1A1 (0.64) KCNMA1DHODHGRM4ALDH1A1CYP2C9
SCHEMBL91757 0.78 HDAC3 (0.52) ALDH1A1RAB9AHPGDMEN1KMT2A
SCHEMBL91556 0.78 MAOB (0.57) RAB9ANPC1MAPT

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-2022000443-A1 METHODS AND COMPOSITIONS FOR TARGETING TREGS USING CCR8 INHIBITORS Nanjing Immunophage Biotech Co., Ltd. (CN) 2022-01-06 WO disclosed