SCHEMBL29978663

SCHEMBL29978663

Oc1ccc(/C=C/c2cnc3ccccc3c2)cc1

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 2/20 0.75
PDGFRA P16234 2/20 0.75
RAB9A P51151 6/20 0.60
KMT2A Q03164 6/20 0.55
ALDH1A1 P00352 5/20 0.55
MAPT P10636 5/20 0.55
MEN1 O00255 5/20 0.55
KDM4E B2RXH2 4/20 0.55
NPC1 O15118 4/20 0.55
SMN1; SMN2 Q16637 3/20 0.55
LMNA P02545 3/20 0.55
L3MBTL1 Q9Y468 2/20 0.55
GAA P10253 3/20 0.49
CASP3 P42574 2/20 0.49
SENP7 Q9BQF6 2/20 0.49
HPGD P15428 1/20 0.49
HTT P42858 1/20 0.49
ATM Q13315 1/20 0.46
SENP6 Q9GZR1 1/20 0.46
PTGS1 P23219 1/20 0.45

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
SCHEMBL3164867 0.86 PDGFRB (1.00) PDGFRBPDGFRARAB9AKMT2AALDH1A1
SCHEMBL3164863 0.86 PDGFRB (1.00) PDGFRBPDGFRARAB9AKMT2AALDH1A1
SCHEMBL2397368 0.81 PDGFRB (0.71) PDGFRBPDGFRARAB9AKMT2AALDH1A1
SCHEMBL2397362 0.81 PDGFRB (0.71) PDGFRBPDGFRARAB9AKMT2AALDH1A1
SCHEMBL31516522 0.81 PDGFRB (0.71) PDGFRBPDGFRARAB9AKMT2AALDH1A1
SCHEMBL9000566 0.81 PDGFRB (0.77) PDGFRBPDGFRARAB9AKMT2AALDH1A1
SCHEMBL9000561 0.81 PDGFRB (0.77) PDGFRBPDGFRARAB9AKMT2AALDH1A1
SCHEMBL563572 0.79 PDGFRB (0.73) PDGFRBPDGFRARAB9AKMT2AALDH1A1
SCHEMBL563573 0.79 PDGFRB (0.73) PDGFRBPDGFRARAB9AKMT2AALDH1A1
SCHEMBL372028 0.78 PDGFRB (0.67) PDGFRBPDGFRARAB9AKMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115160237-A Fluorescent probe for detecting hydrogen sulfide and preparation method and application thereof 王威 2022-10-11 CN claimed
CN-117491283-A Preparation method of dual-mode biomass/paper-based label for indicating food freshness 陕西科技大学 2024-02-02 CN disclosed
CN-115160237-A Fluorescent probe for detecting hydrogen sulfide and preparation method and application thereof 王威 2022-10-11 CN disclosed