SCHEMBL4356244

SCHEMBL4356244

CC1(C)OB(c2ccc(Oc3ccccc3)c(Cl)c2)OC1(C)C

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LPL P06858 7/20 0.47
LIPG Q9Y5X9 7/20 0.47
AAK1 Q2M2I8 1/20 0.42
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
CA9 Q16790 1/20 0.38
DGAT1 O75907 1/20 0.38
PNLIP P16233 2/20 0.37
P4HB P07237 1/20 0.36
CSF1R P07333 1/20 0.36
MRGPRX4 Q96LA9 1/20 0.36
TTR P02766 1/20 0.35

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
SCHEMBL1129289 0.87 LIPG (0.49) LPLLIPGCA1CA2CA9
SCHEMBL1129141 0.83 TTR (0.48) LPLLIPGCA1CA2CA9
SCHEMBL4366318 0.83 LPL (0.47) LPLLIPGCA1CA2CA9
SCHEMBL1129150 0.83 TTR (0.48) LPLLIPGCA1CA2CA9
SCHEMBL17423585 0.82 LPL (0.50) LPLLIPGCA1CA2CA9
SCHEMBL6865570 0.80 LMNA (0.49) LPLLIPGCYP1A2CYP2C9CYP2C19
SCHEMBL6861464 0.80 LPL (0.44) LPLLIPGCA1CA2CA9
SCHEMBL28738862 0.80 DGAT1 (0.51) LPLLIPGAAK1DGAT1MRGPRX4
SCHEMBL1129409 0.79 LIPG (0.43) LPLLIPGAAK1CA1CA2
SCHEMBL5899727 0.78 LPL (0.65) LPLLIPGCA1CA2CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9694011-B2 Substituted pyrazolopyrimidines as kinases inhibitors JIANGSU MEDOLUTION LTD (CN) 2017-07-04 US disclosed
US-9694011-B2 Substituted pyrazolopyrimidines as kinases inhibitors JIANGSU MEDOLUTION LTD (CN) 2017-07-04 US disclosed
US-9694011-B2 Substituted pyrazolopyrimidines as kinases inhibitors JIANGSU MEDOLUTION LTD (CN) 2017-07-04 US disclosed
US-20160120868-A1 SUBSTITUTED PYRAZOLOPYRIMIDINES AS KINASES INHIBITORS JIANGSU MEDOLUTION LTD. (CN) 2016-05-05 US disclosed
US-20160120868-A1 SUBSTITUTED PYRAZOLOPYRIMIDINES AS KINASES INHIBITORS JIANGSU MEDOLUTION LTD. (CN) 2016-05-05 US disclosed
US-20160120868-A1 SUBSTITUTED PYRAZOLOPYRIMIDINES AS KINASES INHIBITORS JIANGSU MEDOLUTION LTD. (CN) 2016-05-05 US disclosed
EP-2999702-A1 SUBSTITUTED PYRAZOLOPYRIMIDINES AS KINASES INHIBITORS Jiangsu Medolution Ltd. (CN) 2016-03-30 EP disclosed
US-8481733-B2 Substituted imidazopyr- and imidazotri-azines OSI Pharmaceuticals, LLC (US) 2013-07-09 US disclosed
EP-2283020-B1 SUBSTITUTED IMIDAZOPYR-AND IMIDAZOTRI-AZINES OSI PHARM INC (US) 2012-10-31 EP disclosed
US-20090286768-A1 SUBSTITUTED IMIDAZOPYR- AND IMIDAZOTRI-AZINES OSI PHARMACEUTICALS, INC. (US) 2009-11-19 US disclosed
US-6713474-B2 SERINE-THREONINE AND TYROSINE KINASE INHIBITORS ABBOTT GMBH & CO. KG (DE) 2004-03-30 US disclosed
US-20030153752-A1 Pyrrolopyrimidines as therapeutic agents ABBVIE DEUTSCHLAND GMBH & CO KG (DE) 2003-08-14 US disclosed
WO-2001072751-A1 PYRROLOPYRIMIDINES AS TYROSINE KINASE INHIBITORS KNOLL GESELLSCHAFT MIT BESCHRAENKTER HAFTUNG (DE) 2001-10-04 WO 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 (3 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-20160120868-A1 SUBSTITUTED PYRAZOLOPYRIMIDINES AS KINASES INHIBITORS BTK, LCK, ABL1 LPL 3126/4885LIPG 2681/4885AAK1 323/4885
US-20030153752-A1 Pyrrolopyrimidines as therapeutic agents FLT1, FLT4, TFPI LPL 3780/4885LIPG 2107/4885AAK1 871/4885
US-20090286768-A1 SUBSTITUTED IMIDAZOPYR- AND IMIDAZOTRI-AZINES ABL1, TPMT, CYP2C19 LPL 4530/4885LIPG 4744/4885AAK1 1736/4885

“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.