SCHEMBL7649256

SCHEMBL7649256

CCCCCCCCCCCCCCCCCCCCc1ccc(C)cc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 2/20 0.65
ADRA2A P08913 2/20 0.65
ADORA3 P0DMS8 2/20 0.65
TACR2 P21452 2/20 0.65
SLC6A2 P23975 2/20 0.65
SLC6A4 P31645 2/20 0.65
SLC6A3 Q01959 2/20 0.65
ALDH1A1 P00352 2/20 0.65
HSD17B10 Q99714 2/20 0.65
KDM4E B2RXH2 1/20 0.65
LMNA P02545 1/20 0.65
SHBG P04278 1/20 0.65
TP53 P04637 1/20 0.65
CYP3A4 P08684 1/20 0.65
HSPD1 P10809 1/20 0.65
ADRB3 P13945 1/20 0.65
HTR2C P28335 1/20 0.65
HSPE1 P61604 1/20 0.65
HIF1A Q16665 1/20 0.65
TST Q16762 1/20 0.65

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
SCHEMBL175632 1.00 ESR1 (0.65) ESR1ADRA2AADORA3TACR2SLC6A2
SCHEMBL396014 1.00 ESR1 (0.65) ESR1ADRA2AADORA3TACR2SLC6A2
SCHEMBL10762522 1.00 ESR1 (0.65) ESR1ADRA2AADORA3TACR2SLC6A2
SCHEMBL395650 1.00 ESR1 (0.65) ESR1ADRA2AADORA3TACR2SLC6A2
SCHEMBL168031 1.00 ESR1 (0.65) ESR1ADRA2AADORA3TACR2SLC6A2
SCHEMBL9678943 1.00 ESR1 (0.65) ESR1ADRA2AADORA3TACR2SLC6A2
Octane SCHEMBL9724037 1.00 ESR1 (0.65) ESR1ADRA2AADORA3TACR2SLC6A2
SCHEMBL167114 1.00 ESR1 (0.65) ESR1ADRA2AADORA3TACR2SLC6A2
SCHEMBL80498 1.00 ESR1 (0.65) ESR1ADRA2AADORA3TACR2SLC6A2
SCHEMBL21963890 1.00 ESR1 (0.65) ESR1ADRA2AADORA3TACR2SLC6A2

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-6476282-B1 SUPERALKALINIZED ISOMERIZED LINEAR ALKYLARYL SULFONATES OF ALKALINE EARTH METALS, USEFUL AS DETERGENT/DISPERSANT ADDITIVES FOR LUBRICATING OILS, AND PROCESSES FOR THEIR PREPARATION AND INTERMEDIATE ALKYLARYL HYDROCARBON CHEVRON CHEMICAL S.A. (FR) 2002-11-05 US disclosed
US-5939594-A Superalkalinized isomerized linear alkylaryl sulfonates of alkaline earth metals, useful as detergent/dispersant additives for lubricating oils, and processes for their preparation and intermediate alkylaryl hydrocarbon CHEVRON CHEMICAL S.A. (FR) 1999-08-17 US disclosed
EP-0731072-B1 Isomerized linear alkylaryl sulphonates, useful as additives for lubricating oils and corresponding alkylaryl hydrocarbons CHEVRON CHEM SA (FR) 1999-06-02 EP disclosed
EP-0731072-A1 Isomerized linear alkylaryl sulphonates, useful as additives for lubricating oils and corresponding alkylaryl hydrocarbons Chevron Chemical S.A. (FR) 1996-09-11 EP disclosed