SCHEMBL9790034

SCHEMBL9790034

CC(=O)NC1C=CCCCC1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.37
CXCR2 P25025 1/20 0.36
RAB9A P51151 6/20 0.36
NPC1 O15118 5/20 0.36
SMN1; SMN2 Q16637 3/20 0.36
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 1/20 0.34
ATM Q13315 1/20 0.32
EPHX1 P07099 1/20 0.32
CYP1A2 P05177 1/20 0.32
HPGD P15428 1/20 0.32
CYP2C19 P33261 1/20 0.32
PSEN1 P49768 2/20 0.31
PSEN2 P49810 2/20 0.31
APH1B Q8WW43 2/20 0.31
NCSTN Q92542 2/20 0.31
APH1A Q96BI3 2/20 0.31
PSENEN Q9NZ42 2/20 0.31

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
SCHEMBL23437156 0.98 MAPT (0.36) MAPTCXCR2RAB9ANPC1SMN1; SMN2
SCHEMBL17696546 0.98 MAPT (0.36) MAPTCXCR2RAB9ANPC1SMN1; SMN2
SCHEMBL6561841 0.94 CXCR2 (0.40) MAPTCXCR2RAB9ANPC1SMN1; SMN2
SCHEMBL10536482 0.86
SCHEMBL17696617 0.86 KDM4E (0.39) MAPTRAB9ANPC1SMN1; SMN2KDM4E
SCHEMBL23636289 0.81 RAB9A (0.36) MAPTCXCR2RAB9ANPC1SMN1; SMN2
SCHEMBL18025072 0.80 MAPT (0.47) MAPTCXCR2RAB9ANPC1SMN1; SMN2
SCHEMBL9790130 0.80 RAB9A (0.37) CXCR2RAB9ANPC1SMN1; SMN2MEN1
SCHEMBL21827898 0.80 KDM4E (0.36) MAPTRAB9ANPC1SMN1; SMN2KDM4E
SCHEMBL21827465 0.80 KDM4E (0.36) MAPTRAB9ANPC1SMN1; SMN2KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5075488-A Fungicides SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1991-12-24 US disclosed
EP-0128006-B1 A SOIL-DISEASE-CONTROLLING AGENT SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1991-09-18 EP disclosed
US-4709052-A FUNGICIDES SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1987-11-24 US disclosed
EP-0128006-A2 A soil-disease-controlling agent SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1984-12-12 EP disclosed