SCHEMBL26501222

SCHEMBL26501222

CC(C)(C)OC1CCN(CCCCCCCCCC(=O)C(C)(C)C)CC1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PAOX Q6QHF9 1/20 0.40
HTR7 P34969 2/20 0.36
CHRM3 P20309 7/20 0.36
NPC1 O15118 1/20 0.35
MLNR O43193 1/20 0.35
NR1I2 O75469 1/20 0.35
EGFR P00533 1/20 0.35
LMNA P02545 1/20 0.35
ERBB2 P04626 1/20 0.35
FYN P06241 1/20 0.35
CHRM2 P08172 1/20 0.35
CHRM4 P08173 1/20 0.35
ABCB1 P08183 1/20 0.35
ADRB1 P08588 1/20 0.35
HTR1A P08908 1/20 0.35
CHRM5 P08912 1/20 0.35
ADRA2A P08913 1/20 0.35
ADORA3 P0DMS8 1/20 0.35
CHRM1 P11229 1/20 0.35
ADRB3 P13945 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
SCHEMBL26501220 1.00 PAOX (0.40) PAOXHTR7CHRM3NPC1MLNR
SCHEMBL26501216 1.00 PAOX (0.40) PAOXHTR7CHRM3NPC1MLNR
SCHEMBL26501248 1.00 PAOX (0.40) PAOXHTR7CHRM3NPC1MLNR
SCHEMBL26501219 1.00 PAOX (0.40) PAOXHTR7CHRM3NPC1MLNR
SCHEMBL26501223 1.00 PAOX (0.40) PAOXHTR7CHRM3NPC1MLNR
SCHEMBL26501233 1.00 PAOX (0.40) PAOXHTR7CHRM3NPC1MLNR
SCHEMBL26501236 0.92 CHRM3 (0.37) PAOXHTR7CHRM3CHRM2
SCHEMBL26504752 0.89 PAOX (0.33) PAOXHTR7CHRM3NPC1MLNR
SCHEMBL26501239 0.88 KMT2A (0.38) MEN1KMT2AHRH3
SCHEMBL26501240 0.86 HRH3 (0.40) CHRM3NPC1MLNRNR1I2EGFR

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-20230321253-A1 BIFUNCTIONAL COMPOUNDS AND PHARMACEUTICAL USES THEREOF Risen (Suzhou) Pharma Tech Co., Ltd. (CN) 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-20230321253-A1 BIFUNCTIONAL COMPOUNDS AND PHARMACEUTICAL USES THEREOF KRAS, MDM2, NRAS PAOX 1898/4885HTR7 4751/4885CHRM3 4809/4885

“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.