SCHEMBL28406341

SCHEMBL28406341

Oc1ccccc1N1C=CC=CC1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 4/20 0.36
KDM4E B2RXH2 3/20 0.36
MAPT P10636 2/20 0.36
POLB P06746 2/20 0.36
XBP1 P17861 1/20 0.36
MAPK1 P28482 1/20 0.36
HTT P42858 1/20 0.36
KCNMA1 Q12791 1/20 0.36
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35
IDO1 P14902 1/20 0.34
METAP2 P50579 1/20 0.34
ALDH1A1 P00352 3/20 0.33
HPGD P15428 3/20 0.33
HIF1A Q16665 2/20 0.33
HSD17B10 Q99714 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
CA12 O43570 1/20 0.33
GMNN O75496 1/20 0.33
EGFR P00533 1/20 0.33

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
SCHEMBL9276285 0.81 MGLL (0.37)
SCHEMBL9276325 0.77 KEAP1 (0.41) GAAKDM4EMAPTHTTALDH1A1
SCHEMBL28000779 0.77 ADRB1 (0.40) KDM4EHTTRAB9AALDH1A1LMNA
SCHEMBL1238592 0.77 MGLL (0.37)
SCHEMBL29958355 0.77
SCHEMBL7789812 0.77 ALDH1A1 (0.41) KDM4EMAPTALDH1A1HPGDSMN1; SMN2
SCHEMBL30118921 0.75 GAA (0.33) GAAKDM4EHTTL3MBTL1
SCHEMBL3319952 0.74 HSD17B10 (0.42) KDM4EMAPTPOLBMAPK1NPC1
SCHEMBL9588021 0.74 NPC1 (0.49) GAAKDM4EMAPTNPC1RAB9A
SCHEMBL5314044 0.73 KDM4E (0.37) KDM4EMAPTHTTALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108493343-B Perovskite film, preparation method thereof and application of film in photoelectric device 清华大学 2020-04-24 CN claimed
EP-4308122-A1 HETEROCYCLIC DERIVATIVES AS JANUS KINASE INHIBITORS Chiesi Farmaceutici S.p.A. (IT) 2024-01-24 EP disclosed
CN-116981459-A Heterocyclic derivatives as janus kinase inhibitors 奇斯药制品公司 2023-10-31 CN disclosed
CN-115667256-A Compounds for treating diseases and methods of treating diseases 艾特里提治疗有限公司 2023-01-31 CN disclosed
WO-2022194779-A1 HETEROCYCLIC DERIVATIVES AS JANUS KINASE INHIBITORS CHIESI FARMACEUTICI S.P.A. (IT) 2022-09-22 WO disclosed
CN-108493343-B Perovskite film, preparation method thereof and application of film in photoelectric device 清华大学 2020-04-24 CN disclosed