SCHEMBL10025915

SCHEMBL10025915

NCCCCCCOP(=O)(O)OCO

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ITPR3 Q14573 1/20 0.42
ITPR1 Q14643 1/20 0.42
LPAR3 Q9UBY5 7/20 0.39
LPAR2 Q9HBW0 6/20 0.39
LPAR1 Q92633 4/20 0.39
FDPS P14324 3/20 0.38
PLA2G2C Q5R387 1/20 0.38
LMNA P02545 2/20 0.37
BLM P54132 2/20 0.37
CYP3A4 P08684 1/20 0.37
NFKB1 P19838 1/20 0.37
PMP22 Q01453 1/20 0.37
GABBR2 O75899 1/20 0.34
CYP1A2 P05177 1/20 0.34
TSHR P16473 1/20 0.34
THPO P40225 1/20 0.34
GABBR1 Q9UBS5 1/20 0.34
P2RY10 O00398 1/20 0.33
PDE3A Q14432 1/20 0.32

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
SCHEMBL23631720 0.92 ITPR3 (0.47) ITPR3ITPR1LPAR3LPAR2LPAR1
SCHEMBL23631717 0.89 ITPR3 (0.49) ITPR3ITPR1LPAR3LPAR2LPAR1
SCHEMBL14727907 0.84 LPAR3 (0.53) ITPR3ITPR1LPAR3LPAR2LPAR1
SCHEMBL8768479 0.83 PLA2G2C (0.38) ITPR3ITPR1FDPSPLA2G2CLMNA
SCHEMBL23631726 0.83 ITPR3 (0.55) ITPR3ITPR1LPAR3LPAR2LPAR1
SCHEMBL10885700 0.82 LPAR3 (0.62) LPAR3LPAR2LPAR1PLA2G2CTSHR
Octadecylamine SCHEMBL9496217 0.82 LPAR3 (0.62) LPAR3LPAR2LPAR1PLA2G2CTSHR
SCHEMBL22221628 0.82 LPAR3 (0.62) LPAR3LPAR2LPAR1PLA2G2CTSHR
Dodecylamine SCHEMBL10887166 0.82 LPAR3 (0.62) LPAR3LPAR2LPAR1PLA2G2CTSHR
SCHEMBL9496121 0.82 LPAR3 (0.62) LPAR3LPAR2LPAR1PLA2G2CTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9506060-B2 LNA antisense oligonucleotides for the modulation of Myc expression DANA-FARBER CANCER INSTITUTE, INC. (US) 2016-11-29 US disclosed
US-20160024495-A1 LNA ANTISENSE OLIGONUCLEOTIDES FOR THE MODULATION OF MYC EXPRESSION ENZON PHARMACEUTICALS, INC. 2016-01-28 US disclosed
US-8450290-B2 Methods for treating androgen receptor dependent disorders including cancers ENZON PHARMACEUTICALS, INC. (US) 2013-05-28 US disclosed
US-8450291-B2 RNA antagonist compounds for the modulation of PIK3CA expression SANTARIS PHARMA A/S (DK) 2013-05-28 US disclosed
US-20120295955-A1 RNA ANTAGONIST COMPOUNDS FOR THE MODULATION OF HER3 SANTARIS PHARMA A/S (DK) 2012-11-22 US disclosed
US-8268793-B2 RNA antagonist compounds for the modulation of HER3 SANTARIS PHARMA A/S (DK) 2012-09-18 US disclosed
US-20120076781-A1 METHODS OF TREATING CANCERS WITH HER3 ANTISENSE OLIGONUCLEOTIDES SANTARIS PHARMA A/S (DK) 2012-03-29 US disclosed
US-20110319471-A1 LNA ANTAGONISTS TARGETING THE ANDROGEN RECEPTOR SANTARIS PHARMA A/S (DK) 2011-12-29 US disclosed
US-7989429-B2 LNA antagonists targeting the androgen receptor ENZON PHARMACEUTICALS, INC. (US) 2011-08-02 US disclosed
US-20110152348-A1 METHODS FOR TREATING ANDROGEN RECEPTOR DEPENDENT DISORDERS INCLUDING CANCERS ENZON PHARMACEUTICALS, INC. (US) 2011-06-23 US disclosed
US-20110077285-A1 RNA ANTAGONIST COMPOUNDS FOR THE MODULATION OF PIK3CA EXPRESSION ENZON PHARMACEUTICALS, INC. (US) 2011-03-31 US disclosed
US-7863437-B2 RNA antagonist compounds for the modulation of PIK3CA expression ENZON PHARMACEUTICALS, INC. (US) 2011-01-04 US disclosed
US-20100323967-A1 RNA Antagonist Compounds for the Modulation of MCL-1 SANTARIS PHARMA A/S (DK) 2010-12-23 US disclosed
US-20100234451-A1 LNA ANTAGONISTS TARGETING THE ANDROGEN RECEPTOR ENZON PHARMACEUTICALS, INC. (US) 2010-09-16 US disclosed
US-7737125-B2 LNA antagonists targeting the androgen receptor ENZON PHARAMACEUTICALS, INC. (US) 2010-06-15 US disclosed
US-20090192110-A1 RNA ANTAGONIST COMPOUNDS FOR THE MODULATION OF PIK3CA EXPRESSION SANTARIS PHARMA A/S 2009-07-30 US disclosed
US-20090005335-A1 COMPOUNDS FOR THE MODULATION OF BETA-CATENIN EXPRESSION SANTARIS PHARMA A/S (DK) 2009-01-01 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 (9 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-20120295955-A1 RNA ANTAGONIST COMPOUNDS FOR THE MODULATION OF HER3 ERBB3, EGFR, ERBB2 ITPR3 2335/4885ITPR1 3442/4885LPAR3 73/4885
US-20110152348-A1 METHODS FOR TREATING ANDROGEN RECEPTOR DEPENDENT DISORDERS INCLUDING CANCERS AR, ESRRB, ESRRA ITPR3 2828/4885ITPR1 2743/4885LPAR3 144/4885
US-20090005335-A1 COMPOUNDS FOR THE MODULATION OF BETA-CATENIN EXPRESSION CTNNB1, CTNNA1, WNT1 ITPR3 3597/4885ITPR1 3674/4885LPAR3 350/4885
US-20090192110-A1 RNA ANTAGONIST COMPOUNDS FOR THE MODULATION OF PIK3CA EXPRESSION PIK3CA, PIK3R4, PIK3R5 ITPR3 1557/4885ITPR1 1449/4885LPAR3 543/4885
US-20100234451-A1 LNA ANTAGONISTS TARGETING THE ANDROGEN RECEPTOR AR, ESRRB, LHCGR ITPR3 3808/4885ITPR1 3944/4885LPAR3 16/4885
US-20110077285-A1 RNA ANTAGONIST COMPOUNDS FOR THE MODULATION OF PIK3CA EXPRESSION PIK3CA, PIK3R4, PIK3R5 ITPR3 1789/4885ITPR1 1710/4885LPAR3 538/4885
US-20120076781-A1 METHODS OF TREATING CANCERS WITH HER3 ANTISENSE OLIGONUCLEOTIDES ERBB3, ERBB2, EGFR ITPR3 741/4885ITPR1 2069/4885LPAR3 39/4885
US-20110319471-A1 LNA ANTAGONISTS TARGETING THE ANDROGEN RECEPTOR AR, ESRRB, LHCGR ITPR3 3808/4885ITPR1 3944/4885LPAR3 16/4885
US-20100323967-A1 RNA Antagonist Compounds for the Modulation of MCL-1 MCL1, NSUN2, MCTS1 ITPR3 2368/4885ITPR1 1795/4885LPAR3 560/4885

“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.