SCHEMBL8914837

SCHEMBL8914837

CCOC(=O)Cc1c[nH]c2cccc(Cl)c12

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.63
GPR84 Q9NQS5 1/20 0.55
NR4A2 P43354 1/20 0.50
SMN1; SMN2 Q16637 3/20 0.48
CYP1A2 P05177 2/20 0.48
CYP3A4 P08684 2/20 0.48
CYP2C19 P33261 2/20 0.48
CYP2D6 P10635 1/20 0.48
CYP2C9 P11712 1/20 0.48
SLC6A4 P31645 1/20 0.48
MAPT P10636 4/20 0.48
KMT2A Q03164 4/20 0.48
ALDH1A1 P00352 3/20 0.48
MEN1 O00255 3/20 0.48
LMNA P02545 2/20 0.48
KDM4E B2RXH2 3/20 0.46
TDP1 Q9NUW8 3/20 0.46
GAA P10253 2/20 0.46
POLB P06746 1/20 0.46
THRB P10828 1/20 0.46

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
SCHEMBL152993 0.86 NR4A2 (0.59) PKMGPR84NR4A2SMN1; SMN2CYP1A2
SCHEMBL5177500 0.85 PKM (0.68) PKMSMN1; SMN2CYP1A2CYP3A4CYP2C19
SCHEMBL9936651 0.84 PKM (0.63) PKMGPR84SMN1; SMN2CYP1A2CYP3A4
SCHEMBL6604411 0.84 PKM (0.63) PKMGPR84SMN1; SMN2CYP1A2CYP3A4
SCHEMBL25139763 0.82 GPR84 (0.59) PKMGPR84NR4A2SLC6A4MAPT
SCHEMBL25139447 0.81 GPR84 (0.63) GPR84NR4A2SLC6A4MAPTKMT2A
SCHEMBL29580629 0.80 ALDH1A1 (0.69) GPR84NR4A2SMN1; SMN2CYP2C9SLC6A4
SCHEMBL154385 0.80 ALDH1A1 (0.69) GPR84NR4A2SMN1; SMN2CYP2C9SLC6A4
SCHEMBL261412 0.80 PKM (0.61) PKMSMN1; SMN2CYP1A2CYP3A4CYP2C19
SCHEMBL19604558 0.79 GPR84 (0.73) GPR84NR4A2SLC6A4MAPTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-9241239-A None JP disclosed
JP-H09241239-A ESTERS OF 4-CHLOROINDOLE-3-ACETIC ACID AGENCY OF IND SCIENCE & TECHNOL 1997-09-16 JP disclosed