SCHEMBL28219655

SCHEMBL28219655

CCn1c(=O)c(Cl)cc2cc(C(=O)O)ccc21

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.48
KMT2A Q03164 3/20 0.48
CCR2 P41597 1/20 0.46
HPGD P15428 3/20 0.45
KDM4E B2RXH2 3/20 0.45
TSHR P16473 2/20 0.45
HSD17B10 Q99714 1/20 0.45
HCAR3 P49019 1/20 0.43
POLB P06746 1/20 0.43
MEN1 O00255 2/20 0.43
MAPT P10636 2/20 0.43
SLC22A12 Q96S37 2/20 0.43
THRB P10828 1/20 0.43
RAB9A P51151 1/20 0.43
GAA P10253 1/20 0.41
HTT P42858 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
RXFP1 Q9HBX9 1/20 0.41
ACSS2 Q9NR19 1/20 0.41
PTGER4 P35408 2/20 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
SCHEMBL28219647 0.89 KMT2A (0.52) ALDH1A1KMT2AKDM4EHSD17B10RAB9A
SCHEMBL28219216 0.81 KDM4E (0.53) ALDH1A1KMT2AHPGDKDM4ETSHR
SCHEMBL14549402 0.80 KMT2A (0.51) ALDH1A1KMT2AHPGDKDM4ETSHR
SCHEMBL28325706 0.76 LMNA (0.48) ALDH1A1KMT2ACCR2HPGDKDM4E
SCHEMBL20183578 0.75 KDM4E (0.53) ALDH1A1KMT2AHPGDKDM4ETSHR
SCHEMBL22004128 0.75 GRIK1 (0.60) ALDH1A1KMT2AHPGDMEN1MAPT
SCHEMBL6205386 0.73 HPD (0.58) ALDH1A1KMT2AHPGDKDM4ETSHR
SCHEMBL8922345 0.73 HPGD (0.65) ALDH1A1KMT2AHPGDKDM4ETSHR
SCHEMBL29629312 0.73 HPGD (0.65) ALDH1A1KMT2AHPGDKDM4ETSHR
SCHEMBL29629313 0.73 HPGD (0.65) ALDH1A1KMT2AHPGDKDM4ETSHR

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-108137505-A Nitrogen-containing heterocycle compound 富士胶片株式会社 2018-06-08 CN disclosed