SCHEMBL6909688

SCHEMBL6909688

CCCCCCCCCCCCCCCCCC(CCCCCCCCCCCC)SOC(=O)CC

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.46
GPR84 Q9NQS5 7/20 0.43
FFAR1 O14842 1/20 0.41
ZDHHC7 Q9NXF8 1/20 0.41
MAPT P10636 1/20 0.40
LCK P06239 1/20 0.40
PPARD Q03181 1/20 0.40
ZDHHC20 Q5W0Z9 1/20 0.40
ZDHHC2 Q9UIJ5 1/20 0.40
LMNA P02545 2/20 0.39
CA2 P00918 1/20 0.39
FAAH O00519 4/20 0.38
CNR1 P21554 1/20 0.38
CNR2 P34972 1/20 0.38
SMPD1 P17405 1/20 0.38

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
SCHEMBL9103962 1.00 NAAA (0.46) NAAAGPR84FFAR1ZDHHC7MAPT
Propionic Acid SCHEMBL1989786 0.95 GPR84 (0.47) NAAAGPR84FFAR1MAPTLCK
SCHEMBL8927805 0.93 NAAA (0.43) NAAAGPR84FFAR1ZDHHC7MAPT
SCHEMBL28451297 0.93 NAAA (0.43) NAAAGPR84FFAR1ZDHHC7MAPT
Methane SCHEMBL15393217 0.91 NAAA (0.42) NAAAGPR84FFAR1ZDHHC7MAPT
SCHEMBL8927454 0.91 NAAA (0.40) NAAAGPR84FFAR1ZDHHC7MAPT
SCHEMBL7978279 0.84 NAAA (0.44) NAAAGPR84FFAR1ZDHHC7LMNA
SCHEMBL533985 0.80 TSHR (0.41) NAAAGPR84ZDHHC7MAPTLMNA
Tridecane SCHEMBL27976809 0.76 NAAA (0.56) NAAAGPR84FFAR1PPARDLMNA
SCHEMBL15558872 0.75 ZDHHC7 (0.42) GPR84FFAR1ZDHHC7MAPTLCK

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
EP-0940440-B1 Block copolymer composition for modifying asphalt and asphalt composition comprising the same JAPAN ELASTOMER COMPANY LTD (JP) 2004-06-16 EP disclosed
US-6150439-A THE POROUS ASPHALT PARTICLES COATED WITH A COPOLYMER COMPRISING MONOALKENYL AROMATIC COMPOUND/CONJUGATED DIENE MONOMERS; EXCELLENT PHYSICAL PROPERTIES SUCH AS DUCTILITY, HIGH SOFTENING POINT, MECHANICAL STRENGTH, STORAGE STABILITY JAPAN ELASTOMER CO., LTD. (JP) 2000-11-21 US disclosed
EP-0940440-A1 Block copolymer composition for modifying asphalt and asphalt composition comprising the same JAPAN ELASTOMER COMPANY LIMITED (JP) 1999-09-08 EP disclosed