SCHEMBL9433005

SCHEMBL9433005

C=C(C)CCCCC.C=CCCCCCCCCCC

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.67
ALDH1A1 P00352 2/20 0.52
MAPT P10636 3/20 0.47
ABCC4 O15439 1/20 0.47
LMNA P02545 2/20 0.46
KMT2A Q03164 3/20 0.43
FAAH O00519 3/20 0.43
MEN1 O00255 2/20 0.43
CYP3A4 P08684 2/20 0.43
TERT O14746 3/20 0.42
CYP1A2 P05177 2/20 0.42
CYP2C19 P33261 2/20 0.42
BLM P54132 2/20 0.42
HSD17B10 Q99714 2/20 0.42
FABP4 P15090 2/20 0.42
PTPN1 P18031 2/20 0.42
PPARG P37231 2/20 0.42
PPARD Q03181 2/20 0.42
PPARA Q07869 2/20 0.42
GMNN O75496 1/20 0.42

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
SCHEMBL8823837 1.00 TSHR (0.67) TSHRALDH1A1MAPTABCC4LMNA
SCHEMBL7719841 0.96 TSHR (0.67) TSHRALDH1A1MAPTABCC4LMNA
SCHEMBL8413864 0.91 MAPT (0.54) TSHRALDH1A1MAPTABCC4LMNA
SCHEMBL20863642 0.91 MAPT (0.54) TSHRALDH1A1MAPTABCC4LMNA
SCHEMBL774740 0.91 MAPT (0.54) TSHRALDH1A1MAPTABCC4LMNA
SCHEMBL23014107 0.91 MAPT (0.54) TSHRALDH1A1MAPTABCC4LMNA
SCHEMBL23014106 0.91 MAPT (0.54) TSHRALDH1A1MAPTABCC4LMNA
SCHEMBL25492822 0.91 MAPT (0.54) TSHRALDH1A1MAPTABCC4LMNA
SCHEMBL23014262 0.91 MAPT (0.54) TSHRALDH1A1MAPTABCC4LMNA
SCHEMBL1907176 0.89 TSHR (0.53) TSHRALDH1A1MAPTABCC4LMNA

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-5304315-A Prevention of gel formation in two-cycle oils EXXON CHEMICAL PATENTS INC. (US) 1994-04-19 US disclosed