SCHEMBL19918852

SCHEMBL19918852

CCCCCCCC(C)(CCCCCCC)n1cc(C)cn1

nearest known ligand 0.36

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 9/20 0.36
CNR1 P21554 7/20 0.33
HTT P42858 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
SCHEMBL19918757 1.00 CNR2 (0.36) CNR2CNR1HTT
SCHEMBL24861843 0.79 JAK2 (0.33)
SCHEMBL21166150 0.71 CNR2 (0.31) CNR2CNR1
SCHEMBL21720901 0.70 CNR2 (0.33) CNR2CNR1
SCHEMBL25523336 0.69 NOS1 (0.37) CNR2CNR1
SCHEMBL25770507 0.69 LMNA (0.41) CNR2CNR1
SCHEMBL19326463 0.69 LMNA (0.41) CNR2CNR1
SCHEMBL19250952 0.69 NOS1 (0.37) CNR2CNR1
SCHEMBL19918764 0.69 NOS1 (0.37) CNR2CNR1
SCHEMBL21165922 0.69 CNR2 (0.35) CNR2CNR1HTT

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-20180055054-A1 PYRAZOLONE COMPOUND OR SALT THEREOF, PREPARATION METHOD THEREFOR, HERBICIDE COMPOSITION AND USE THEREOF QINGDAO KINGAGROOT CHEMICAL COMPOUNDS CO., LTD. (CN) 2018-03-01 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-20180055054-A1 PYRAZOLONE COMPOUND OR SALT THEREOF, PREPARATION METHOD THEREFOR, HERBICIDE COMPOSITION AND USE THEREOF THEM6, NOTUM, CYP4F11 CNR2 808/4885CNR1 589/4885HTT 2510/4885

“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.