SCHEMBL30075707

SCHEMBL30075707

c1ccc2c(c1)ccc1oc3cncnc3c12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AHR P35869 4/20 0.43
TDP1 Q9NUW8 3/20 0.40
CYP1A2 P05177 3/20 0.39
NPC1 O15118 3/20 0.39
RAB9A P51151 3/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
L3MBTL1 Q9Y468 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
ABCG2 Q9UNQ0 2/20 0.38
PAX8 Q06710 2/20 0.38
EGFR P00533 1/20 0.38
CYP1A1 P04798 1/20 0.38
FYN P06241 1/20 0.38
MAPK3 P27361 1/20 0.38
LIMK1 P53667 1/20 0.37
HNF4A P41235 1/20 0.37
XRCC6 P12956 1/20 0.36
XRCC5 P13010 1/20 0.36
PRKDC P78527 1/20 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
SCHEMBL22476343 1.00 AHR (0.43) AHRTDP1CYP1A2NPC1RAB9A
SCHEMBL19758265 0.81 SMN1; SMN2 (0.45) TDP1CYP1A2NPC1RAB9ACYP2C9
SCHEMBL30356598 0.79 CYP1A2 (0.42) TDP1CYP1A2NPC1RAB9ACYP2C9
SCHEMBL22483141 0.79 CYP1A2 (0.42) TDP1CYP1A2NPC1RAB9ACYP2C9
SCHEMBL483929 0.78 SMN1; SMN2 (0.51) TDP1CYP1A2NPC1RAB9ACYP2C9
SCHEMBL25461393 0.77 KDM4E (0.39) CYP1A2NPC1RAB9ACYP2C19L3MBTL1
SCHEMBL22483138 0.75 EGFR (0.39) CYP1A2NPC1RAB9ACYP2C9CYP2C19
SCHEMBL26771405 0.75 SMN1; SMN2 (0.42) TDP1CYP1A2NPC1RAB9ACYP2C9
SCHEMBL22788545 0.75 CCR1 (0.44) AHRTDP1CYP1A2NPC1RAB9A
SCHEMBL30365643 0.75 CCR1 (0.44) AHRTDP1CYP1A2NPC1RAB9A

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
US-20220367831-A1 Light-Emitting Device, Light-Emitting Apparatus, Electronic Appliance, and Lighting Device SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2022-11-17 US disclosed