SCHEMBL28629227

SCHEMBL28629227

Cc1c2ccccc2nc2[nH]c3ccccc3c12

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.64
HSD17B10 Q99714 4/20 0.64
LMNA P02545 4/20 0.64
MAPT P10636 4/20 0.64
ALDH1A1 P00352 4/20 0.64
CYP1A2 P05177 3/20 0.64
CYP3A4 P08684 3/20 0.64
TSHR P16473 3/20 0.64
POLB P06746 3/20 0.64
HPGD P15428 3/20 0.64
CYP2C9 P11712 2/20 0.64
CYP2C19 P33261 2/20 0.64
NPC1 O15118 2/20 0.54
TP53 P04637 2/20 0.54
CASP1 P29466 2/20 0.54
RAB9A P51151 2/20 0.54
CASP7 P55210 2/20 0.54
SMN1; SMN2 Q16637 2/20 0.54
MAPK10 P53779 1/20 0.54
TOP2A P11388 2/20 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
SCHEMBL17286169 0.82 KDM4E (0.51) KDM4EHSD17B10LMNAMAPTALDH1A1
SCHEMBL6306638 0.72 KDM4E (0.57) KDM4EHSD17B10LMNAMAPTALDH1A1
SCHEMBL6215793 0.72 KDM4E (0.56) KDM4EHSD17B10LMNAMAPTALDH1A1
SCHEMBL20982276 0.72 ALDH1A1 (0.55) KDM4EHSD17B10LMNAMAPTALDH1A1
SCHEMBL8390746 0.71 GPR3 (0.50) KDM4EHSD17B10LMNAMAPTALDH1A1
SCHEMBL31656035 0.71 KDM4E (0.51) KDM4EHSD17B10LMNAMAPTALDH1A1
SCHEMBL17047835 0.71 EGFR (0.49) KDM4EHSD17B10LMNAMAPTALDH1A1
SCHEMBL30254691 0.71 EGFR (0.49) KDM4EHSD17B10LMNAMAPTALDH1A1
SCHEMBL278729 0.71 RAB9A (1.00) KDM4EHSD17B10LMNAMAPTALDH1A1
SCHEMBL29572859 0.71 RAB9A (1.00) KDM4EHSD17B10LMNAMAPTALDH1A1

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
CN-113336749-B Preparation method of indoloquinoline compound 湖北工业大学 2022-04-29 CN disclosed
CN-113336749-A Preparation method of indoloquinoline compound 湖北工业大学 2021-09-03 CN disclosed