SCHEMBL24345252

SCHEMBL24345252

CC1CC2CC(C)CC(n3cnc4ccccc43)(C1)C2

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 2/20 0.48
CYP11B2 P19099 2/20 0.48
HCAR1 Q9BXC0 1/20 0.43
DDB1 Q16531 1/20 0.37
CRBN Q96SW2 1/20 0.37
IKZF3 Q9UKT9 1/20 0.37
PI4KA P42356 1/20 0.36
PI4K2B Q8TCG2 1/20 0.36
PI4K2A Q9BTU6 1/20 0.36
PI4KB Q9UBF8 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
HTT P42858 3/20 0.35
OPRM1 P35372 1/20 0.34
OPRL1 P41146 1/20 0.34
LMNA P02545 3/20 0.34
SMN1; SMN2 Q16637 3/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
TSHR P16473 2/20 0.34
MAPK1 P28482 2/20 0.34

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
SCHEMBL31321057 0.90 CYP11B1 (0.57) CYP11B1CYP11B2HCAR1DDB1CRBN
SCHEMBL24329965 0.90 CYP11B1 (0.57) CYP11B1CYP11B2HCAR1DDB1CRBN
SCHEMBL24345245 0.68
SCHEMBL18236377 0.68
SCHEMBL19095852 0.68 OPRM1 (0.50) DDB1CRBNIKZF3OPRM1OPRL1
SCHEMBL19095853 0.68 OPRM1 (0.50) DDB1CRBNIKZF3OPRM1OPRL1
SCHEMBL19095850 0.68 OPRM1 (0.50) DDB1CRBNIKZF3OPRM1OPRL1
SCHEMBL15353266 0.65 CDK4 (0.38) CYP11B1CYP11B2HCAR1PI4KAPI4K2B
SCHEMBL18236380 0.65 DRD2 (0.54) CYP11B1CYP11B2DDB1CRBNIKZF3
SCHEMBL2546299 0.65 CYP11B1 (0.54) CYP11B1CYP11B2TDP1HTTLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11691135-B2 Synthesis of alkynones via carbonylative Sonogashira coupling reactions catalyzed by Pd(II)-N-Heterocyclic carbene-pyridine complexes KING FAHD UNIVERSITY OF PETROLEUM & MINERALS (SA) 2023-07-04 US disclosed
US-20220118435-A1 SYNTHESIS OF ALKYNONES VIA CARBONYLATIVE SONOGASHIRA COUPLING REACTIONS CATALYZED BY PD(II)-N-HETEROCYCLIC CARBENE-PYRIDINE COMPLEXES KING FAHD UNIVERSITY OF PETROLEUM & MINERALS (SA) 2022-04-21 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 (2 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-11691135-B2 Synthesis of alkynones via carbonylative Sonogashira coupling reactions catalyzed by Pd(II)-N-Heterocyclic carbene-pyridine complexes PDK2, SNCA, YAP1 CYP11B1 978/4885CYP11B2 273/4885HCAR1 4508/4885
US-20220118435-A1 SYNTHESIS OF ALKYNONES VIA CARBONYLATIVE SONOGASHIRA COUPLING REACTIONS CATALYZED BY PD(II)-N-HETEROCYCLIC CARBENE-PYRIDINE COMPLEXES PDK2, SNCA, YAP1 CYP11B1 978/4885CYP11B2 273/4885HCAR1 4508/4885

“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.