SCHEMBL22193586

SCHEMBL22193586

C#CCCCCOP(=O)(O)OCC

nearest known ligand 0.59

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ LPAR3 Q9UBY5 7/20 0.40
▸ LPAR2 Q9HBW0 5/20 0.40
▸ LPAR1 Q92633 4/20 0.40
▸ TSHR P16473 1/20 0.34
▸ CYP2D6 P10635 2/20 0.33
▸ CYP1A2 P05177 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ CYP2C9 P11712 1/20 0.33
▸ CYP2C19 P33261 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33
▸ PPARD Q03181 1/20 0.33
▸ CA12 O43570 1/20 0.33
▸ CA1 P00915 1/20 0.33
▸ CA2 P00918 1/20 0.33
▸ CA9 Q16790 1/20 0.33

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
SCHEMBL26334857 0.91 CYP2D6 (0.39) LPAR3LPAR2LPAR1CYP2D6CYP1A2
SCHEMBL26334849 0.89 CYP2D6 (0.42) LPAR3LPAR2LPAR1CYP2D6CYP1A2
SCHEMBL26334850 0.89 CYP2D6 (0.42) LPAR3LPAR2LPAR1CYP2D6CYP1A2
SCHEMBL26334858 0.89 CYP2D6 (0.42) LPAR3LPAR2LPAR1CYP2D6CYP1A2
SCHEMBL16417850 0.88 LPAR3 (0.47) LPAR3LPAR2LPAR1CYP2D6CYP1A2
SCHEMBL26460406 0.87 LPAR3 (0.36) LPAR3LPAR2LPAR1TSHRCYP2D6
SCHEMBL12914743 0.84 LPAR3 (0.52) LPAR3LPAR2LPAR1TSHRPPARD
SCHEMBL17327639 0.84 LPAR3 (0.37) LPAR3LPAR2LPAR1CYP2D6CYP1A2
SCHEMBL25584062 0.82 LPAR3 (0.40) LPAR3LPAR2LPAR1CYP2D6CYP1A2
SCHEMBL11994572 0.80 LMNA (0.46) LPAR3LPAR2LPAR1

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-11008613-B2 Tagged nucleotides useful for nanopore detection Roche Sequencing Solutions, Inc. (US) 2021-05-18 — — US disclosed
US-20200216894-A1 TAGGED NUCLEOTIDES USEFUL FOR NANOPORE DETECTION Roche Sequencing Solutions, Inc. (US) 2020-07-09 — — 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 (2 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-20200216894-A1 TAGGED NUCLEOTIDES USEFUL FOR NANOPORE DETECTION PHAX, POLRMT, POLN LPAR3 3474/4885LPAR2 3499/4885LPAR1 3376/4885
US-11008613-B2 Tagged nucleotides useful for nanopore detection PHAX, POLRMT, POLN LPAR3 3474/4885LPAR2 3499/4885LPAR1 3376/4885

“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.

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