SCHEMBL31301909

SCHEMBL31301909

CCCc1cnc2c(O)ccc(Cl)c2c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.45
BRD4 O60885 2/20 0.45
LMNA P02545 1/20 0.45
HSP90AA1 P07900 1/20 0.45
MAPT P10636 1/20 0.45
METAP2 P50579 1/20 0.45
METAP1 P53582 1/20 0.45
CNR1 P21554 1/20 0.41
CNR2 P34972 1/20 0.41
CA12 O43570 2/20 0.38
CA1 P00915 2/20 0.38
CA2 P00918 2/20 0.38
CA6 P23280 2/20 0.38
CA7 P43166 2/20 0.38
CA13 Q8N1Q1 2/20 0.38
IDO1 P14902 1/20 0.36
NPC1 O15118 3/20 0.36
NFKB1 P19838 2/20 0.36
RAB9A P51151 2/20 0.36
NFKB2 Q00653 2/20 0.36

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
SCHEMBL31301969 0.91 NPC1 (0.46) KDM4EBRD4LMNAHSP90AA1MAPT
SCHEMBL31301800 0.88 KDM4E (0.47) KDM4EBRD4LMNAHSP90AA1MAPT
SCHEMBL31301815 0.81 KDM4E (0.44) KDM4EBRD4LMNAHSP90AA1MAPT
SCHEMBL11688674 0.76 MAPT (0.51) KDM4EBRD4LMNAHSP90AA1MAPT
SCHEMBL31301792 0.72 KDM4E (0.47) KDM4EBRD4LMNAHSP90AA1MAPT
SCHEMBL31301943 0.72 MAPT (0.47) KDM4EBRD4LMNAHSP90AA1MAPT
SCHEMBL9512057 0.68 CNR1 (0.59) CNR1CNR2NFKB1IGF1RALOX15
SCHEMBL10282386 0.68 ALDH1A1 (0.44) KDM4ELMNACA12CA1CA2
SCHEMBL631374 0.68 CNR1 (0.64) CNR1CNR2CA1CA2NFKB1
SCHEMBL8838401 0.67 CRHR1 (0.37) KDM4EMAPTNPC1RAB9ASMN1; SMN2

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-119390735-A Hydroxyquinoline coordinated catalyst, preparation method, composite catalyst and application 上海元革新材料科技有限公司 2025-02-07 CN disclosed