SCHEMBL3213883

SCHEMBL3213883

CCCCCCCCCCCCCC(C)c1ccc(O)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 7/20 0.50
ESR2 Q92731 4/20 0.50
ADORA3 P0DMS8 3/20 0.50
SLC6A2 P23975 3/20 0.50
SLC6A3 Q01959 3/20 0.50
ADRA2A P08913 2/20 0.50
TACR2 P21452 2/20 0.50
SLC6A4 P31645 2/20 0.50
LMNA P02545 2/20 0.50
CYP3A4 P08684 2/20 0.50
CHRM2 P08172 2/20 0.50
CHRM1 P11229 2/20 0.50
PTGS1 P23219 2/20 0.50
KDM4E B2RXH2 1/20 0.50
ALDH1A1 P00352 1/20 0.50
SHBG P04278 1/20 0.50
TP53 P04637 1/20 0.50
HSPD1 P10809 1/20 0.50
ADRB3 P13945 1/20 0.50
HTR2C P28335 1/20 0.50

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
SCHEMBL10583267 1.00 ESR1 (0.50) ESR1ESR2ADORA3SLC6A2SLC6A3
SCHEMBL3950842 1.00 ESR1 (0.50) ESR1ESR2ADORA3SLC6A2SLC6A3
SCHEMBL6745552 1.00 ESR1 (0.50) ESR1ESR2ADORA3SLC6A2SLC6A3
SCHEMBL8511827 1.00 ESR1 (0.50) ESR1ESR2ADORA3SLC6A2SLC6A3
SCHEMBL9804621 1.00 ESR1 (0.50) ESR1ESR2ADORA3SLC6A2SLC6A3
SCHEMBL25172266 1.00 ESR1 (0.50) ESR1ESR2ADORA3SLC6A2SLC6A3
SCHEMBL4410688 1.00 ESR1 (0.50) ESR1ESR2ADORA3SLC6A2SLC6A3
SCHEMBL9353521 1.00 ESR1 (0.50) ESR1ESR2ADORA3SLC6A2SLC6A3
SCHEMBL20845445 1.00 ESR1 (0.50) ESR1ESR2ADORA3SLC6A2SLC6A3
SCHEMBL6686936 0.98 ESR1 (0.52) ESR1ESR2ADORA3SLC6A2SLC6A3

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
CN-101671596-B Detergent composition INFINEUM INT LTD 2014-07-02 CN disclosed
US-8404627-B2 Detergent comprising C10 to C40 hydrocarbyl substituted hydroxybenzoates for reducing asphaltene precipitation INFINEUM INTERNATIONAL LIMITED (GB) 2013-03-26 US disclosed
CN-101671596-A Detergent composition INFINEUM INT LTD 2010-03-17 CN disclosed
US-20100062958-A1 Detergent INFINEUM INTERNATIONAL LIMITED (GB) 2010-03-11 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100062958-A1 Detergent HDHD5, DSG1, HSD17B10 ESR1 2793/4885ESR2 4296/4885ADORA3 4463/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.