SCHEMBL5605814

SCHEMBL5605814

C=C(CC)CC(C)CCCCC

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ACE2 Q9BYF1 1/20 0.42
OPRM1 P35372 1/20 0.39
CA1 P00915 2/20 0.38
SPHK1 Q9NYA1 1/20 0.38
LMNA P02545 1/20 0.37
TP53 P04637 1/20 0.36
GPR84 Q9NQS5 6/20 0.35
FDPS P14324 2/20 0.34
PRKD3 O94806 1/20 0.34
PRKCG P05129 1/20 0.34
PRKCB P05771 1/20 0.34
PRKCA P17252 1/20 0.34
PRKCH P24723 1/20 0.34
PRKCI P41743 1/20 0.34
PRKCE Q02156 1/20 0.34
PRKCQ Q04759 1/20 0.34
PRKCZ Q05513 1/20 0.34
PRKCD Q05655 1/20 0.34
PRKD1 Q15139 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
SCHEMBL7743524 0.87 ACE2 (0.42) ACE2OPRM1CA1SPHK1LMNA
SCHEMBL21850507 0.85 LMNA (0.46) ACE2LMNA
SCHEMBL7743761 0.83 ACE2 (0.44) ACE2OPRM1SPHK1LMNAGPR84
SCHEMBL7743672 0.83 ACE2 (0.44) ACE2OPRM1SPHK1LMNAGPR84
SCHEMBL15249648 0.81 ACE2 (0.46) ACE2OPRM1CA1SPHK1LMNA
SCHEMBL7744252 0.80 ACE2 (0.38) ACE2OPRM1CA1SPHK1LMNA
SCHEMBL7744146 0.80 LMNA (0.41) ACE2OPRM1CA1SPHK1LMNA
SCHEMBL18860354 0.80 ACE2 (0.38) ACE2OPRM1CA1SPHK1LMNA
SCHEMBL24357018 0.79 ACE2 (0.48) ACE2OPRM1SPHK1LMNAPRKD3
SCHEMBL7744228 0.79 ACE2 (0.40) ACE2LMNAGPR84

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7256317-B2 subjecting olefin mixture to metathesis, separating olefins, dimerizing, derivatizing (via hydroformylation) after fractionation, then alkoxylating; BASF AKTIENGESELLSCHAFT (DE) 2007-08-14 US disclosed
US-20040186325-A1 subjecting olefin mixture to metathesis, separating olefins, dimerizing, derivatizing (via hydroformylation) after fractionation, then alkoxylating; BASF AKTIENGESELLSCHAFT (DE) 2004-09-23 US disclosed
US-6737553-B1 SUBJECTING A C4-OLEFIN MIXTURE TO METATHESIS, DIMERIZING, DERIVATIZING BASF AKTIENGESELLSCHAFT (DE) 2004-05-18 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-20040186325-A1 subjecting olefin mixture to metathesis, separating olefins, dimerizing, derivatizing (via hydroformylation) after fractionation, then alkoxylating; OSTC, ADH1C, PHOSPHO1 ACE2 2837/4885OPRM1 670/4885CA1 2737/4885

“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.