SCHEMBL16337448

SCHEMBL16337448

COc1cc(B(O)OC(C)(C)C(C)(C)O)ccc1CO

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PDCD1 Q15116 2/20 0.39
CD274 Q9NZQ7 2/20 0.39
PDE4A P27815 1/20 0.36
PDE4B Q07343 1/20 0.36
PDE4C Q08493 1/20 0.36
PDE4D Q08499 1/20 0.36
GAA P10253 1/20 0.31
MAPT P10636 1/20 0.31
TSHR P16473 1/20 0.31
MAPK1 P28482 1/20 0.31
HTT P42858 1/20 0.31

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
SCHEMBL19692162 0.84 CA2 (0.36) TSHR
SCHEMBL22336 0.81 MAOB (0.43) TSHRMAPK1HTT
SCHEMBL1559901 0.80 ALDH1A1 (0.42) GAAMAPTTSHRHTT
SCHEMBL1277500 0.78 ALDH1A1 (0.38) GAAMAPTTSHR
SCHEMBL18580455 0.78 ALDH1A1 (0.46) TSHR
SCHEMBL16687408 0.77 PDCD1 (0.47) PDCD1CD274PDE4APDE4BPDE4C
SCHEMBL473910 0.76 KDM4E (0.37) GAAMAPTMAPK1HTT
SCHEMBL16346292 0.76 TNFSF11 (0.41) GAAMAPTTSHRMAPK1
SCHEMBL9894132 0.76 NR3C1 (0.47) GAAMAPTTSHR
SCHEMBL6696220 0.76 RIPK1 (0.40)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9932360-B2 Qualitative and quantitative point-of-care assays THE PENN STATE RESEARCH FOUNDATION (US) 2018-04-03 US disclosed
US-9200131-B2 Organic acid-modified polymers for golf ball constructions and methods relating thereto ACUSHNET COMPANY (US) 2015-12-01 US disclosed
US-20150005193-A1 QUALITATIVE AND QUANTITATIVE POINT-OF-CARE ASSAYS NATIONAL SCIENCE FOUNDATION 2015-01-01 US disclosed
US-20150005101-A1 ORGANIC ACID-MODIFIED POLYMERS FOR GOLF BALL CONSTRUCTIONS AND METHODS RELATING THERETO JPMORGAN CHASE BANK, N.A., AS SUCCESSOR ADMINISTRATIVE AGENT 2015-01-01 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 (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-20150005193-A1 QUALITATIVE AND QUANTITATIVE POINT-OF-CARE ASSAYS CUTA, AQP4, CD63 PDCD1 1701/4885CD274 1005/4885PDE4A 2937/4885

“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.