SCHEMBL7180563

SCHEMBL7180563

C=CCCCCCCCCCCCC=C(CCC=C)CCCCCCCCCCC=C

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.50
ABCC4 O15439 1/20 0.50
ALDH1A1 P00352 3/20 0.44
LMNA P02545 2/20 0.44
TSHR P16473 2/20 0.41
LPAR3 Q9UBY5 2/20 0.35
LPAR2 Q9HBW0 1/20 0.35
TRPA1 O75762 2/20 0.33
CYP3A4 P08684 2/20 0.32
USP2 O75604 1/20 0.32
RECQL P46063 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL1273786 0.90 TSHR (0.59) MAPTABCC4ALDH1A1LMNATSHR
SCHEMBL3700429 0.90 TSHR (0.59) MAPTABCC4ALDH1A1LMNATSHR
SCHEMBL5716967 0.85 TSHR (0.64) MAPTABCC4ALDH1A1LMNATSHR
SCHEMBL1274968 0.85 TSHR (0.64) MAPTABCC4ALDH1A1LMNATSHR
SCHEMBL6556651 0.85 TSHR (0.64) MAPTABCC4ALDH1A1LMNATSHR
SCHEMBL11670742 0.85 TSHR (0.64) MAPTABCC4ALDH1A1LMNATSHR
SCHEMBL3737327 0.85 TSHR (0.64) MAPTABCC4ALDH1A1LMNATSHR
SCHEMBL6698175 0.85 TSHR (0.64) MAPTABCC4ALDH1A1LMNATSHR
SCHEMBL7625618 0.85 TSHR (0.64) MAPTABCC4ALDH1A1LMNATSHR
SCHEMBL594656 0.85 TSHR (0.58) MAPTABCC4ALDH1A1LMNATSHR

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-1335941-A1 PROCESS FOR PREPARING AND METHOD OF USING A DRAG REDUCING AGENT Fortum OYJ (FI) 2003-08-20 EP disclosed
WO-2002034802-A1 PROCESS FOR PREPARING AND METHOD OF USING A DRAG REDUCING AGENT FORTUM OYJ (FI) 2002-05-02 WO disclosed
EP-0690902-A1 METHOD OF SUPPRESSING MIST FORMATION FROM OIL-CONTAINING FUNCTIONAL FLUIDS EXXON CHEMICAL PATENTS INC (US) 1996-01-10 EP disclosed