SCHEMBL18591263

SCHEMBL18591263

CC(C)(C)OC(=O)Cn1cc(C(N)=O)c2cc(-c3ccc4c(c3)CCCC4)ccc21

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ ICMT O60725 4/20 0.41
▸ SERPINE1 P05121 4/20 0.36
▸ CFD P00746 3/20 0.36
▸ KRAS P01116 1/20 0.35
▸ NPC1 O15118 1/20 0.34
▸ RAB9A P51151 1/20 0.34
▸ SYK P43405 2/20 0.34
▸ NR1H2 P55055 1/20 0.34
▸ SCN9A Q15858 1/20 0.34
▸ CNR1 P21554 1/20 0.33
▸ CNR2 P34972 1/20 0.33
▸ GAA P10253 1/20 0.33

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
SCHEMBL29841210 1.00 ICMT (0.41) ICMTSERPINE1CFDKRASNPC1
SCHEMBL18555837 0.96 ICMT (0.42) ICMTSERPINE1CFDKRASSYK
SCHEMBL29841081 0.87 ICMT (0.38) ICMTSERPINE1CFDKRAS
SCHEMBL18591239 0.87 ICMT (0.38) ICMTSERPINE1CFDKRAS
SCHEMBL18611187 0.84 ICMT (0.40) ICMTCFDSYK
SCHEMBL29546024 0.84 ICMT (0.43) ICMTSERPINE1CFDCNR1CNR2
SCHEMBL18555286 0.84 ICMT (0.43) ICMTSERPINE1CFDCNR1CNR2
SCHEMBL18611186 0.83 ICMT (0.48) ICMTSCN9ACNR1CNR2
SCHEMBL20329709 0.82 ICMT (0.45) ICMTSERPINE1CFDGAA
SCHEMBL29774760 0.82 ICMT (0.45) ICMTSERPINE1CFDGAA

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-20230287005-A1 ARYL, HETEROARYL, AND HETEROCYCLIC COMPOUNDS FOR TREATMENT OF MEDICAL DISORDERS ACHILLION PHARMACEUTICALS, INC. 2023-09-14 — — US disclosed
CN-114044800-A Aryl, heteroaryl and heterocyclic compounds for the treatment of medical disorders 艾其林医药公司 2022-02-15 — — CN disclosed
US-20170066783-A1 Aryl, Heteroaryl, and Heterocyclic Compounds for Treatment of Medical Disorders ACHILLION PHARMACEUTICALS, INC. (US) 2017-03-09 — — 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-20170066783-A1 Aryl, Heteroaryl, and Heterocyclic Compounds for Treatment of Medical Disorders CFD, F12, F3 ICMT 4435/4885SERPINE1 40/4885CFD 1/4885
US-20230287005-A1 ARYL, HETEROARYL, AND HETEROCYCLIC COMPOUNDS FOR TREATMENT OF MEDICAL DISORDERS CFD, F12, F3 ICMT 4537/4885SERPINE1 39/4885CFD 1/4885

“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.

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