SCHEMBL10567467

SCHEMBL10567467

CCC/N=C(\C)Nc1cccc(O)n1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPK8 P45983 1/20 0.37
▸ ADRA2A P08913 4/20 0.35
▸ ADRA2B P18089 3/20 0.35
▸ ADRA2C P18825 3/20 0.35
▸ SMN1; SMN2 Q16637 4/20 0.34
▸ LMNA P02545 2/20 0.34
▸ KDM4E B2RXH2 1/20 0.34
▸ RAB9A P51151 3/20 0.33
▸ NPC1 O15118 2/20 0.33
▸ GRM5 P41594 2/20 0.33
▸ ALDH1A1 P00352 2/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ CHRNB2 P17787 1/20 0.32
▸ CHRNB4 P30926 1/20 0.32
▸ CHRNA3 P32297 1/20 0.32
▸ CHRNA4 P43681 1/20 0.32
▸ TP53 P04637 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ HSD17B10 Q99714 1/20 0.32

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
SCHEMBL7295809 1.00 MAPK8 (0.37) MAPK8ADRA2AADRA2BADRA2CSMN1; SMN2
SCHEMBL10562070 0.72 KMT2A (0.37) KDM4EALDH1A1MEN1KMT2AMAPT
SCHEMBL7285751 0.72 KMT2A (0.37) KDM4EALDH1A1MEN1KMT2AMAPT
SCHEMBL16943227 0.71 KDM4E (0.62) MAPK8SMN1; SMN2LMNAKDM4ERAB9A
SCHEMBL19151419 0.70 SMN1; SMN2 (0.53) MAPK8SMN1; SMN2RAB9ANPC1ALDH1A1
SCHEMBL24329605 0.69 CHRNB2 (0.46) KDM4EALDH1A1CHRNB2CHRNB4CHRNA3
SCHEMBL28530934 0.69 SMN1; SMN2 (0.51) MAPK8SMN1; SMN2LMNAKDM4ERAB9A
SCHEMBL22937086 0.69 CACNA1C (0.51) MAPK8GRM5MEN1KMT2AHSD17B10
SCHEMBL10463823 0.67 SMN1; SMN2 (0.63) SMN1; SMN2KDM4ERAB9ANPC1ALDH1A1
SCHEMBL7286157 0.66 GRIN2D (0.32) SMN1; SMN2RAB9ANPC1ALDH1A1

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
US-4863938-A Pyridine derivatives and their use as nootropic agents CIBA-GEIGY CORPORATION (US) 1989-09-05 — — US claimed
US-4863938-A Pyridine derivatives and their use as nootropic agents CIBA-GEIGY CORPORATION (US) 1989-09-05 — — US disclosed
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