SCHEMBL578320

SCHEMBL578320

COCOc1ccc(B2OC(C)(C)C(C)(C)O2)cc1F

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LPL P06858 10/20 0.43
LIPG Q9Y5X9 10/20 0.43
ROCK1 Q13464 1/20 0.40
CSF1R P07333 1/20 0.36
EGFR P00533 1/20 0.36
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA9 Q16790 1/20 0.35
AAK1 Q2M2I8 1/20 0.35
DGAT1 O75907 1/20 0.35
HIF1A Q16665 2/20 0.35
F11 P03951 1/20 0.35
BACE1 P56817 1/20 0.34
BACE2 Q9Y5Z0 1/20 0.34

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
SCHEMBL16815507 0.89 LPL (0.43) LPLLIPGROCK1CSF1REGFR
SCHEMBL1331278 0.87 LPL (0.42) LPLLIPGROCK1CSF1REGFR
SCHEMBL578694 0.84 LPL (0.40) LPLLIPGCSF1RCA1CA2
SCHEMBL142144 0.83 LPL (0.49) LPLLIPGROCK1CSF1REGFR
SCHEMBL25340242 0.83 LPL (0.36) LPLLIPGROCK1CSF1RCA1
SCHEMBL29509764 0.83 LPL (0.36) LPLLIPGROCK1CSF1RCA1
SCHEMBL15968930 0.83 AAK1 (0.49) LPLLIPGCSF1REGFRCA1
SCHEMBL3192898 0.82 LIPG (0.45) LPLLIPGROCK1EGFRAAK1
SCHEMBL28624112 0.82 LPL (0.42) LPLLIPGROCK1EGFRCA1
SCHEMBL14994486 0.81 HIF1A (0.39) LPLLIPGCSF1RCA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2418203-B1 CYCLIC COMPOUND HAVING SUBSTITUTED PHENYL GROUP DAIICHI SANKYO CO LTD (JP) 2013-12-11 EP disclosed
US-8410273-B2 Cyclic compound having substituted phenyl group DAIICHI SANKYO COMPANY, LIMITED (JP) 2013-04-02 US disclosed
US-8410273-B2 Cyclic compound having substituted phenyl group DAIICHI SANKYO COMPANY, LIMITED (JP) 2013-04-02 US disclosed
US-20120040936-A1 CYCLIC COMPOUND HAVING SUBSTITUTED PHENYL GROUP DAIICHI SANKYO COMPANY, LIMITED (JP) 2012-02-16 US disclosed
US-20120040936-A1 CYCLIC COMPOUND HAVING SUBSTITUTED PHENYL GROUP DAIICHI SANKYO COMPANY, LIMITED (JP) 2012-02-16 US disclosed
EP-2418203-A1 CYCLIC COMPOUND HAVING SUBSTITUTED PHENYL GROUP Daiichi Sankyo Company, Limited (JP) 2012-02-15 EP 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-20120040936-A1 CYCLIC COMPOUND HAVING SUBSTITUTED PHENYL GROUP BMP2, BMP4, BMP6 LPL 2204/4885LIPG 1246/4885ROCK1 688/4885

“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.