SCHEMBL11223364

SCHEMBL11223364

CCCCCCCCCCCCc1cccc2ccccc12.[NaH].[NaH]

nearest known ligand 0.64

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
LIPG Q9Y5X9 1/20 0.53
BCHE P06276 1/20 0.50
MAPT P10636 2/20 0.49
KCNH2 Q12809 1/20 0.48
TLR8 Q9NR97 3/20 0.48
CYP1A2 P05177 2/20 0.47
CYP2C19 P33261 2/20 0.47
CYP2D6 P10635 1/20 0.47
CNR1 P21554 1/20 0.47
SIGMAR1 Q99720 1/20 0.47
NQO2 P16083 1/20 0.46
TAAR1 Q96RJ0 1/20 0.46
CYP2C9 P11712 1/20 0.46

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
SCHEMBL28082479 1.00 LIPG (0.53) LIPGBCHEMAPTKCNH2TLR8
SCHEMBL10798228 1.00 LIPG (0.53) LIPGBCHEMAPTKCNH2TLR8
SCHEMBL28082729 1.00 LIPG (0.53) LIPGBCHEMAPTKCNH2TLR8
SCHEMBL28082493 1.00 LIPG (0.53) LIPGBCHEMAPTKCNH2TLR8
SCHEMBL4736993 1.00 LIPG (0.53) LIPGBCHEMAPTKCNH2TLR8
SCHEMBL28082552 1.00 LIPG (0.53) LIPGBCHEMAPTKCNH2TLR8
SCHEMBL28082645 1.00 LIPG (0.53) LIPGBCHEMAPTKCNH2TLR8
SCHEMBL28082884 1.00 LIPG (0.53) LIPGBCHEMAPTKCNH2TLR8
SCHEMBL6138963 1.00 LIPG (0.53) LIPGBCHEMAPTKCNH2TLR8
SCHEMBL28082682 1.00 LIPG (0.53) LIPGBCHEMAPTKCNH2TLR8

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-4360514-A MOUTHWASHES, DENTIFRICES; ORAL DISEASES; CHEWING GUM; ANTIDEPOSIT AGENTS JOHNSON & JOHNSON PRODUCTS INC. (US) 1982-11-23 US disclosed