SCHEMBL23545819

SCHEMBL23545819

CC(C)COC(=O)CCCCc1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LPAR1 Q92633 7/20 0.60
ADRB2 P07550 1/20 0.56
ADRB1 P08588 1/20 0.56
ADRB3 P13945 1/20 0.56
MAPT P10636 1/20 0.53
RXFP1 Q9HBX9 1/20 0.53
TDP1 Q9NUW8 1/20 0.53
FAAH O00519 3/20 0.51
ALOX5 P09917 2/20 0.50
HPGD P15428 2/20 0.50
ALDH1A1 P00352 1/20 0.49
KMT2A Q03164 1/20 0.49

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
SCHEMBL28226601 0.95 ADRB2 (0.61) LPAR1ADRB2ADRB1ADRB3TDP1
SCHEMBL3185725 0.89 TDP1 (0.68) ADRB2ADRB1ADRB3MAPTTDP1
SCHEMBL31657295 0.85 ADRB2 (0.57) LPAR1ADRB2ADRB1ADRB3TDP1
SCHEMBL11043709 0.84 ALDH1A1 (0.53) LPAR1ADRB2ADRB1ADRB3TDP1
SCHEMBL7970656 0.84 LPAR1 (0.47) LPAR1ADRB2ADRB1ADRB3MAPT
SCHEMBL7971409 0.84 LPAR1 (0.47) LPAR1ADRB2ADRB1ADRB3MAPT
SCHEMBL7968764 0.84 LPAR1 (0.47) LPAR1ADRB2ADRB1ADRB3MAPT
SCHEMBL6328999 0.82 ALOX5 (0.69) LPAR1MAPTRXFP1TDP1ALOX5
SCHEMBL19024934 0.82 ADRB2 (0.57) LPAR1ADRB2ADRB1ADRB3MAPT
SCHEMBL27770588 0.82 ADRB2 (0.57) LPAR1ADRB2ADRB1ADRB3TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210189289-A1 Functionalized Branched Alcohols As Non-Ionic Sugar Surfactants EXXONMOBIL RES & ENG CO (US) 2021-06-24 US disclosed
US-20210188749-A1 Surfactant Performance Through Carbon Chain Extension And Lower Branching EXXONMOBIL RES & ENG CO (US) 2021-06-24 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-20210188749-A1 Surfactant Performance Through Carbon Chain Extension And Lower Branching CCL11, SPTSSB, PAOX LPAR1 1168/4885ADRB2 235/4885ADRB1 280/4885

“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.