SCHEMBL30136402

SCHEMBL30136402

COc1cc2cccnc2cc1OCCCN1CCC(C)CC1

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 1/20 0.56
PDGFRA P16234 1/20 0.56
EHMT2 Q96KQ7 8/20 0.55
EHMT1 Q9H9B1 6/20 0.55
KDM4E B2RXH2 4/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
HRH3 Q9Y5N1 4/20 0.50
ATM Q13315 1/20 0.49
ALDH1A1 P00352 2/20 0.47
LMNA P02545 2/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
DNMT1 P26358 1/20 0.47
MET P08581 1/20 0.47

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
SCHEMBL24444648 0.87 PDGFRB (0.59) PDGFRBPDGFRAEHMT2EHMT1HRH3
SCHEMBL29616380 0.85 PDGFRB (0.57) PDGFRBPDGFRAEHMT2EHMT1ATM
SCHEMBL29565672 0.77 EHMT2 (0.63) EHMT2EHMT1DNMT1
SCHEMBL5070073 0.76 PDGFRB (0.59) PDGFRBPDGFRAEHMT2HRH3DNMT1
SCHEMBL9377191 0.76 PDGFRA (0.59) PDGFRBPDGFRAEHMT2EHMT1
SCHEMBL29566096 0.75 EHMT2 (0.70) EHMT2EHMT1DNMT1
SCHEMBL4299023 0.74 PDGFRB (1.00) PDGFRBPDGFRASMN1; SMN2ALDH1A1
SCHEMBL30997309 0.73 PDGFRB (0.68) PDGFRBPDGFRASMN1; SMN2ATMLMNA
Hydrochloric Acid SCHEMBL29357672 0.73 PDGFRB (0.96) PDGFRBPDGFRASMN1; SMN2ALDH1A1
SCHEMBL1591237 0.72 AXL (0.80) PDGFRAMET

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-111393363-B 4-phenoxy quinoline and N-sulfonyl amidine compound and preparation method and application thereof 威海海洋生物医药产业技术研究院有限公司 2022-12-20 CN disclosed