SCHEMBL764316

SCHEMBL764316

COC(=O)C(CC(C)C)C(C)(C)C

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.41
ADAM17 P78536 1/20 0.39
MME P08473 2/20 0.39
CA12 O43570 2/20 0.37
CA14 Q9ULX7 2/20 0.37
CA7 P43166 2/20 0.37
CA9 Q16790 1/20 0.37
TAS1R3 Q7RTX0 3/20 0.37
TAS1R1 Q7RTX1 3/20 0.37
NOS3 P29474 3/20 0.35
NOS1 P29475 3/20 0.35
NOS2 P35228 3/20 0.35
MMP1 P03956 1/20 0.35
MMP2 P08253 1/20 0.35
MMP3 P08254 1/20 0.35
CA1 P00915 2/20 0.35
CA2 P00918 2/20 0.35
BIRC2 Q13490 1/20 0.35
POLB P06746 1/20 0.35

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
SCHEMBL13869052 1.00 SMN1; SMN2 (0.41) SMN1; SMN2ADAM17MMECA12CA14
SCHEMBL762169 1.00 SMN1; SMN2 (0.41) SMN1; SMN2ADAM17MMECA12CA14
SCHEMBL15060855 0.82 CA1 (0.36) SMN1; SMN2ADAM17MMETAS1R3TAS1R1
SCHEMBL14748186 0.81 TSHR (0.45) SMN1; SMN2CA7MMP1MMP2MMP3
SCHEMBL13537881 0.81 MMP8 (0.41) MMP1MMP2MMP3
SCHEMBL14770005 0.81 TSHR (0.36) ADAM17CA7MMP1MMP2MMP3
SCHEMBL13946436 0.80 TSHR (0.34) ADAM17CA12CA9TAS1R3TAS1R1
SCHEMBL10069154 0.78 HCAR2 (0.37) TAS1R3TAS1R1MMP1MMP2MMP3
SCHEMBL13690140 0.78 TSHR (0.36) MMP1MMP2MMP3
SCHEMBL13690831 0.77 CA1 (0.47) SMN1; SMN2CA12CA14CA7CA9

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-20230130685-A1 Binder Composition for Secondary Battery, Negative Electrode for Secondary Battery Including the Same, and Lithium Secondary Battery Including the Same SK ON CO., LTD. (KR) 2023-04-27 US disclosed
US-8138177-B2 Benzimidazolone derivatives as CB2 receptor ligands PFIZER INC. (US) 2012-03-20 US disclosed
US-20090181957-A1 BENZIMIDAZOLONE DERIVATIVES AS CB2 RECEPTOR LIGANDS ANDO KAZUO 2009-07-16 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-20090181957-A1 BENZIMIDAZOLONE DERIVATIVES AS CB2 RECEPTOR LIGANDS TRPV1, CNR1, CNR2 SMN1; SMN2 1260/4885ADAM17 4126/4885MME 4157/4885

“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.