SCHEMBL26516196

SCHEMBL26516196

CCCCCCC[C@](C)(CCCCC)C1CC[C@H](N)C1

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GNAI3 P08754 2/20 0.36
GNAO1 P09471 2/20 0.36
GNAI1 P63096 2/20 0.36
SPHK1 Q9NYA1 1/20 0.34
CNR2 P34972 7/20 0.31
SMPD1 P17405 2/20 0.31
CES2 O00748 1/20 0.31
FDPS P14324 1/20 0.31
LPAR1 Q92633 1/20 0.31
LPAR3 Q9UBY5 1/20 0.31
CNR1 P21554 1/20 0.31

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
SCHEMBL26513247 1.00 GNAI3 (0.36) GNAI3GNAO1GNAI1SPHK1CNR2
SCHEMBL20833075 0.89 GNAI3 (0.42) GNAI3GNAO1GNAI1SPHK1CNR2
SCHEMBL23745297 0.89 GNAI3 (0.42) GNAI3GNAO1GNAI1SPHK1CNR2
SCHEMBL24429447 0.85 GNAI3 (0.38) GNAI3GNAO1GNAI1SPHK1
SCHEMBL23745437 0.75 SMPD1 (0.34) GNAO1SMPD1FDPS
SCHEMBL14863742 0.72 CYP1A2 (0.33) CNR2FDPSCNR1
SCHEMBL24435761 0.72 GNAO1 (0.46) GNAI3GNAO1GNAI1
SCHEMBL18609539 0.72 GNAO1 (0.46) GNAI3GNAO1GNAI1
SCHEMBL21180109 0.72 GNAO1 (0.46) GNAI3GNAO1GNAI1
SCHEMBL11680394 0.72 CYP1A2 (0.43) CES2LPAR1LPAR3CNR1

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-20230322792-A1 CDK9 INHIBITORS BAERENKRAFT THERAPEUTICS, LLC 2023-10-12 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-20230322792-A1 CDK9 INHIBITORS CDK9, CDK19, CDK3 GNAI3 1172/4885GNAO1 2017/4885GNAI1 1010/4885

“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.