SCHEMBL11093025

SCHEMBL11093025

C=CCC(C)([O])CCCCC

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.39
GGPS1 O95749 7/20 0.38
ALDH1A1 P00352 1/20 0.37
FDPS P14324 11/20 0.33
FAAH O00519 1/20 0.32
CES2 O00748 1/20 0.31
LPAR1 Q92633 1/20 0.31
LPAR3 Q9UBY5 1/20 0.31
SMPD1 P17405 1/20 0.31

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
SCHEMBL3774446 0.82 TSHR (0.42) TSHRGGPS1ALDH1A1FDPSFAAH
SCHEMBL9585050 0.80 TSHR (0.46) TSHRGGPS1ALDH1A1FDPSFAAH
SCHEMBL4733861 0.80 TSHR (0.46) TSHRGGPS1ALDH1A1FDPSFAAH
SCHEMBL27879310 0.80 TSHR (0.46) TSHRGGPS1ALDH1A1FDPSFAAH
Hydrochloric Acid SCHEMBL28154624 0.77 TSHR (0.43) TSHRGGPS1ALDH1A1FDPSFAAH
SCHEMBL23716824 0.76 GGPS1 (0.52) TSHRGGPS1FDPSCES2LPAR1
SCHEMBL2346919 0.76 GGPS1 (0.52) TSHRGGPS1FDPSCES2LPAR1
SCHEMBL4655895 0.76 GGPS1 (0.52) TSHRGGPS1FDPSCES2LPAR1
SCHEMBL1277109 0.76 TSHR (0.46) TSHRGGPS1ALDH1A1FDPSFAAH
SCHEMBL21625685 0.76 TSHR (0.41) TSHRGGPS1ALDH1A1FDPSSMPD1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4465602-A Oil recovery method utilizing an alkylarylpolyalkoxyalkylene sulfonate TEXACO INC. (US) 1984-08-14 US disclosed
US-4442043-A Oil recovery method utilizing a dicyclopentadiene derived ethoxysulfonate TEXACO INC. (US) 1984-04-10 US disclosed
US-4426302-A Oil recovery method utilizing a dicyclopentadiene derived ethoxysulfonate TEXACO INC. (US) 1984-01-17 US disclosed
US-4364431-A Method for recovering oil from an underground formation NATIONAL IRANIAN OIL COMPANY (IR) 1982-12-21 US disclosed