SCHEMBL23201238

SCHEMBL23201238

CCCC(C)C(C)(C)CCC(=O)OC

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.41
CA12 O43570 5/20 0.37
CA14 Q9ULX7 5/20 0.37
CA2 P00918 3/20 0.37
CA1 P00915 2/20 0.37
BIRC2 Q13490 1/20 0.34
CA7 P43166 2/20 0.33
CA9 Q16790 2/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
TET2 Q6N021 1/20 0.33
SLC1A1 P43005 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
PPARG P37231 1/20 0.33
RECQL P46063 2/20 0.32
KDM4E B2RXH2 1/20 0.32
LMNA P02545 1/20 0.32
HPGD P15428 1/20 0.32
HSD17B10 Q99714 1/20 0.32

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
SCHEMBL8424337 0.79 TSHR (0.50) TSHRCA12CA14CA7CA9
SCHEMBL20976973 0.76
SCHEMBL21016162 0.72 TSHR (0.52) TSHRCA12CA14CA2CA7
SCHEMBL21925384 0.71 TSHR (0.32) TSHR
SCHEMBL27602147 0.71 TSHR (0.50) TSHRCA12CA14CA2CA7
SCHEMBL16329096 0.71 TSHR (0.50) TSHRCA12CA14CA7CA9
SCHEMBL13880228 0.71 TSHR (0.50) TSHRCA12CA14CA2CA1
SCHEMBL27652882 0.71 TSHR (0.50) TSHRCA12CA14CA2CA1
SCHEMBL10936782 0.70 TSHR (0.44) TSHRCA12CA14CA7CA9
SCHEMBL13997246 0.70 TSHR (0.33) TSHR

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-20210101878-A1 Cannabinergic Compounds And Uses Thereof NORTHEASTERN UNIVERSITY 2021-04-08 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-20210101878-A1 Cannabinergic Compounds And Uses Thereof CNR2, CNR1, GPR18 TSHR 1550/4885CA12 2982/4885CA14 3242/4885

“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.