SCHEMBL3308166

SCHEMBL3308166

CCCC(=CCC/C=C/CCCCO)CCC

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 2/20 0.41
TOP1 P11387 3/20 0.40
TERT O14746 3/20 0.37
CYP1A2 P05177 2/20 0.37
MAPT P10636 2/20 0.37
CYP2C19 P33261 2/20 0.37
BLM P54132 2/20 0.37
HSD17B10 Q99714 2/20 0.37
FABP4 P15090 2/20 0.37
F7 P08709 2/20 0.37
F3 P13726 2/20 0.37
FAAH O00519 2/20 0.37
PTPN1 P18031 2/20 0.37
PPARG P37231 2/20 0.37
KMT2A Q03164 2/20 0.37
PPARD Q03181 2/20 0.37
PPARA Q07869 2/20 0.37
GMNN O75496 1/20 0.37
USP2 O75604 1/20 0.37
LMNA P02545 1/20 0.37

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
SCHEMBL3308169 1.00 CNR1 (0.41) CNR1TOP1TERTCYP1A2MAPT
SCHEMBL309127 0.87 SMN1; SMN2 (0.43) CNR1HSD17B10PPARGKMT2APPARA
SCHEMBL26624796 0.85 LMNA (0.46) HSD17B10PPARGKMT2APPARALMNA
SCHEMBL27843211 0.85 F7 (0.45) TOP1TERTCYP1A2MAPTCYP2C19
SCHEMBL1486206 0.80 TOP1 (0.36) TOP1TERTCYP1A2MAPTCYP2C19
SCHEMBL2573100 0.78 PPARG (0.68) TOP1TERTCYP1A2MAPTCYP2C19
SCHEMBL18626135 0.78 LMNA (0.42) CNR1HSD17B10PPARGKMT2APPARA
SCHEMBL811708 0.76 LMNA (0.57) TOP1TERTCYP1A2MAPTCYP2C19
SCHEMBL18837248 0.76 LMNA (0.65) TOP1TERTCYP1A2MAPTCYP2C19
SCHEMBL2878007 0.76 LMNA (0.57) TOP1TERTCYP1A2MAPTCYP2C19

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
US-3988380-A REACTING A 2-ALKENYL PHOSPHONIC ACID WITH AN ALUMINUM OR ALUMINUM METAL HYDRIDE SAGAMI CHEMICAL RESEARCH CENTER (JA) 1976-10-26 US claimed
US-20100098788-A1 Extracts of Curcuma and Methods of Use Thereof HERBALSCIENCE GROUP, LLC 2010-04-22 US disclosed
US-3988380-A REACTING A 2-ALKENYL PHOSPHONIC ACID WITH AN ALUMINUM OR ALUMINUM METAL HYDRIDE SAGAMI CHEMICAL RESEARCH CENTER (JA) 1976-10-26 US disclosed