SCHEMBL17517833

SCHEMBL17517833

CCCCCCCCC1(CCCCCCCC)c2cc(B3OCCCCO3)ccc2-c2ccc(B3OCCCCO3)cc21

nearest known ligand 0.33

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
LPL P06858 5/20 0.33
LIPG Q9Y5X9 5/20 0.33
CNR1 P21554 3/20 0.32
CNR2 P34972 3/20 0.32
PDK2 Q15119 1/20 0.30

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
SCHEMBL4262919 0.97 LPL (0.33) LPLLIPGCNR1CNR2
SCHEMBL793599 0.97 LPL (0.33) LPLLIPGCNR1CNR2
SCHEMBL793157 0.97 LPL (0.33) LPLLIPGCNR1CNR2
SCHEMBL403451 0.95 LPL (0.35) LPLLIPGCNR1CNR2
SCHEMBL409142 0.95 LPL (0.35) LPLLIPGCNR1CNR2
SCHEMBL14087192 0.95 LPL (0.35) LPLLIPGCNR1CNR2
SCHEMBL4262758 0.95 LPL (0.35) LPLLIPGCNR1CNR2
SCHEMBL30015088 0.95 LPL (0.35) LPLLIPGCNR1CNR2
SCHEMBL14666214 0.95 LPL (0.35) LPLLIPGCNR1CNR2
SCHEMBL20169752 0.92 LPL (0.33) LPLLIPGCNR1CNR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9748487-B2 Polymers based on naphthodiones BASF SE (DE) 2017-08-29 US disclosed
US-20160049588-A1 POLYMERS BASED ON NAPHTHODIONES BASF SE (DE) 2016-02-18 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-20160049588-A1 POLYMERS BASED ON NAPHTHODIONES CCND2, CCND1, PCNA LPL 4371/4885LIPG 4566/4885CNR1 4512/4885

“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.