SCHEMBL10348751

SCHEMBL10348751

CCC(C)c1cc(C(C)(C)CC(C)(C)C)c(O)c(C(C)(C)CC(C)(C)C)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.38
ALOX15 P16050 2/20 0.38
HSD17B10 Q99714 2/20 0.38
USP2 O75604 1/20 0.38
GAA P10253 1/20 0.38
PKM P14618 1/20 0.38
HPGD P15428 1/20 0.38
RORC P51449 1/20 0.37
HDAC4 P56524 1/20 0.36
HDAC2 Q92769 1/20 0.36
HDAC8 Q9BY41 1/20 0.36
SHBG P04278 1/20 0.35
CYP1A2 P05177 2/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C9 P11712 3/20 0.32
TSHR P16473 2/20 0.32
CYP3A4 P08684 2/20 0.32
CYP2C19 P33261 1/20 0.32
CA2 P00918 2/20 0.31
CA1 P00915 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
SCHEMBL9305081 0.86 ALDH1A1 (0.40) ALDH1A1ALOX15HSD17B10USP2GAA
SCHEMBL11617023 0.84 SHBG (0.38) ALDH1A1ALOX15HSD17B10GAAPKM
SCHEMBL10348753 0.82 CNR1 (0.38) ALDH1A1ALOX15HSD17B10USP2GAA
SCHEMBL144821 0.82 CA2 (0.50) ALDH1A1ALOX15HSD17B10USP2GAA
SCHEMBL5929169 0.77 AKR1C3 (0.37) ALDH1A1HSD17B10HPGDCYP2C9TSHR
SCHEMBL9332354 0.75 SHBG (0.48) ALDH1A1ALOX15HSD17B10USP2GAA
SCHEMBL28417205 0.74 HSPA5 (0.50) ALDH1A1ALOX15USP2GAAHPGD
SCHEMBL2951999 0.74 CYP1A2 (0.44) ALDH1A1ALOX15HSD17B10USP2GAA
SCHEMBL767213 0.74 SHBG (0.52) ALDH1A1ALOX15HSD17B10USP2GAA
SCHEMBL226090 0.74 ALDH1A1 (0.58) ALDH1A1ALOX15HSD17B10GAASHBG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0285608-B1 WATER-IN-OIL EMULSIONS The Lubrizol Corporation (US) 1990-08-01 EP disclosed
EP-0364511-A1 WATER-IN-OIL EMULSIONS The Lubrizol Corporation (US) 1990-04-25 EP disclosed
US-4846985-A HYDROXYSULFIDE OR SECONDARY AMINE COMPOUND THE LUBRIZOL CORPORATION (US) 1989-07-11 US disclosed
US-4844756-A SALT DERIVED FROM HYDROCARBYL-SUBSTITUTED CARBOXYLIC ACID OR ANHYDRIDE OR DERIVATIVE, AND AMMONIA, AN AMINE, OR ALKALI OR ALKALINE EARTH METAL THE LUBRIZOL CORPORATION (US) 1989-07-04 US disclosed
WO-1989005848-A1 WATER-IN-OIL EMULSIONS THE LUBRIZOL CORPORATION (US) 1989-06-29 WO disclosed
EP-0285608-A1 WATER-IN-OIL EMULSIONS. LUBRIZOL CORP (US) 1988-10-12 EP disclosed
US-4708753-A NITROGEN CONTAINING SALT EMULSIFIERS; HYDRAULIC FLUIDS, EXPLOSIVES, ACIDIZING FLUIDS THE LUBRIZOL CORPORATION (US) 1987-11-24 US disclosed
WO-1987003613-A2 WATER-IN-OIL EMULSIONS THE LUBRIZOL CORPORATION (US) 1987-06-18 WO disclosed