SCHEMBL21115798

SCHEMBL21115798

CCCCCCCC(CCCCCC)C(C)C(NC(C)=O)C(=O)OC

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ZDHHC7 Q9NXF8 1/20 0.49
PLA2G2A P14555 4/20 0.47
PLA2G2C Q5R387 6/20 0.46
BIRC2 Q13490 2/20 0.45
ABCB1 P08183 1/20 0.43
CNR1 P21554 2/20 0.41
DAGLA Q9Y4D2 2/20 0.41
FAAH O00519 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
TRPV1 Q8NER1 1/20 0.40

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
SCHEMBL16199754 0.81 ZDHHC7 (0.51) ZDHHC7PLA2G2APLA2G2CBIRC2ABCB1
SCHEMBL9731631 0.81 ZDHHC7 (0.51) ZDHHC7PLA2G2APLA2G2CBIRC2ABCB1
SCHEMBL16199773 0.81 ZDHHC7 (0.51) ZDHHC7PLA2G2APLA2G2CBIRC2ABCB1
SCHEMBL11685164 0.80 ABCB1 (0.49) ZDHHC7PLA2G2APLA2G2CBIRC2ABCB1
SCHEMBL10602631 0.76 GPR84 (0.48) PLA2G2APLA2G2CFAAH
SCHEMBL19085541 0.74 ZDHHC7 (0.53) ZDHHC7PLA2G2APLA2G2CBIRC2ABCB1
SCHEMBL8232200 0.74 ZDHHC7 (0.53) ZDHHC7PLA2G2APLA2G2CBIRC2ABCB1
SCHEMBL28534551 0.72 ZDHHC7 (0.56) ZDHHC7BIRC2ABCB1CNR1FAAH
SCHEMBL28951567 0.72 ZDHHC7 (0.56) ZDHHC7BIRC2ABCB1CNR1FAAH
SCHEMBL560716 0.71 ZDHHC7 (0.63) ZDHHC7BIRC2ABCB1CNR1FAAH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190194242-A1 PHOSPHOROUS PROTECTING GROUPS AND METHODS OF PREPARATION AND USE THEREOF UNIVERSITY OF COLORADO BOULDER 2019-06-27 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-20190194242-A1 PHOSPHOROUS PROTECTING GROUPS AND METHODS OF PREPARATION AND USE THEREOF POLN, POLRMT, NUDT21 ZDHHC7 4448/4885PLA2G2A 1065/4885PLA2G2C 345/4885

“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.