SCHEMBL12091539

SCHEMBL12091539

C#CCCCCOP(C)(=O)O

nearest known ligand 0.55

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ SAT1 P21673 1/20 0.44
▸ CYP2D6 P10635 7/20 0.41
▸ CYP1A2 P05177 1/20 0.41
▸ MAPT P10636 1/20 0.41
▸ CYP2C9 P11712 1/20 0.41
▸ CYP2C19 P33261 1/20 0.41
▸ HSD17B10 Q99714 1/20 0.41
▸ LPAR3 Q9UBY5 7/20 0.39
▸ LPAR2 Q9HBW0 6/20 0.39
▸ LPAR1 Q92633 4/20 0.39
▸ CYP3A4 P08684 4/20 0.34
▸ KDM4E B2RXH2 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ HPGD P15428 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
SCHEMBL19924374 0.83 LPAR3 (0.52) CYP2D6CYP1A2MAPTCYP2C9CYP2C19
SCHEMBL26334857 0.83 CYP2D6 (0.39) CYP2D6CYP1A2MAPTCYP2C9CYP2C19
SCHEMBL12914742 0.82 SAT1 (0.57) SAT1CYP1A2LPAR3LPAR2LPAR1
SCHEMBL26334858 0.82 CYP2D6 (0.42) CYP2D6CYP1A2MAPTCYP2C9CYP2C19
SCHEMBL26334849 0.82 CYP2D6 (0.42) CYP2D6CYP1A2MAPTCYP2C9CYP2C19
SCHEMBL26334850 0.82 CYP2D6 (0.42) CYP2D6CYP1A2MAPTCYP2C9CYP2C19
SCHEMBL17327639 0.81 LPAR3 (0.37) CYP2D6CYP1A2MAPTCYP2C9CYP2C19
SCHEMBL16815002 0.80 LPAR3 (0.56) SAT1LPAR3LPAR2LPAR1CYP3A4
SCHEMBL16815019 0.80 LPAR3 (0.56) SAT1LPAR3LPAR2LPAR1CYP3A4
SCHEMBL16815020 0.80 LPAR3 (0.56) SAT1LPAR3LPAR2LPAR1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230167441-A1 Segmented Nucleic Acids ZHONG MINGHONG (US) 2023-06-01 — — US disclosed
US-20150209440-A1 CONJUGATES, PARTICLES, COMPOSITIONS, AND RELATED METHODS OF USE CERULEAN PHARMA INC. (US) 2015-07-30 — — US disclosed
US-20140296322-A1 CONJUGATES, PARTICLES, COMPOSITIONS, AND RELATED METHODS OF USE CERULEAN PHARMA INC. (US) 2014-10-02 — — US disclosed
US-20140037573-A1 CONJUGATES, PARTICLES, COMPOSITIONS, AND RELATED METHODS CERULEAN PHARMA INC (US) 2014-02-06 — — US disclosed
US-20130236986-A1 METHODS OF SEPARATING NUCLEIC ACID POLYMER CONJUGATES CERULEAN PHARMA INC. (US) 2013-09-12 — — US disclosed
US-20120302622-A1 CONJUGATES, PARTICLES, COMPOSITIONS, AND RELATED METHODS CERULEAN PHARMA INC. (US) 2012-11-29 — — US disclosed
US-20120225129-A1 CONJUGATES, PARTICLES, COMPOSITIONS, AND RELATED METHODS CERULEAN PHARMA INC. (US) 2012-09-06 — — 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 (5 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-20140296322-A1 CONJUGATES, PARTICLES, COMPOSITIONS, AND RELATED METHODS OF USE CD44, DIS3, POLN SAT1 3944/4885CYP2D6 4285/4885CYP1A2 4735/4885
US-20140037573-A1 CONJUGATES, PARTICLES, COMPOSITIONS, AND RELATED METHODS SYNCRIP, EXOSC5, EXOSC9 SAT1 3806/4885CYP2D6 4308/4885CYP1A2 4681/4885
US-20120302622-A1 CONJUGATES, PARTICLES, COMPOSITIONS, AND RELATED METHODS SYNCRIP, EXOSC5, EXOSC9 SAT1 3806/4885CYP2D6 4308/4885CYP1A2 4681/4885
US-20150209440-A1 CONJUGATES, PARTICLES, COMPOSITIONS, AND RELATED METHODS OF USE CD44, DIS3, POLN SAT1 3944/4885CYP2D6 4285/4885CYP1A2 4735/4885
US-20120225129-A1 CONJUGATES, PARTICLES, COMPOSITIONS, AND RELATED METHODS SYNCRIP, EXOSC5, EXOSC9 SAT1 3806/4885CYP2D6 4308/4885CYP1A2 4681/4885

“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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