SCHEMBL22615399

SCHEMBL22615399

CC(C)(NC(=O)c1[nH]nc2c1CN(C(=O)c1cc3ccccn3c1)CC2)C(F)(F)F

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CHRNA7 P36544 1/20 0.35
▸ EP300 Q09472 4/20 0.34
▸ CREBBP Q92793 4/20 0.34
▸ SSTR4 P31391 1/20 0.34
▸ CFTR P13569 3/20 0.33
▸ MTHFD2 P13995 3/20 0.33
▸ BRD4 O60885 2/20 0.33
▸ GRM5 P41594 1/20 0.31
▸ DGAT2 Q96PD7 1/20 0.31
▸ PRLHR P49683 2/20 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
SCHEMBL22615328 0.86 GSK3B (0.37) CHRNA7CFTRMTHFD2PRLHR
SCHEMBL22615211 0.86 GSK3B (0.37) CHRNA7CFTRMTHFD2PRLHR
SCHEMBL22615213 0.86 GSK3B (0.37) CHRNA7CFTRMTHFD2PRLHR
SCHEMBL22615335 0.84 DDR1 (0.34) CHRNA7EP300CREBBPCFTRMTHFD2
SCHEMBL22615242 0.84 CHRNA7 (0.35) CHRNA7EP300CREBBPCFTRMTHFD2
SCHEMBL22615579 0.83 MTHFD2 (0.40) CHRNA7CFTRMTHFD2
SCHEMBL22615301 0.83 CHRNA7 (0.33) CHRNA7CFTRMTHFD2GRM5
SCHEMBL22615322 0.81 CHRNA7 (0.34) CHRNA7MTHFD2PRLHR
SCHEMBL22615401 0.79 AURKA (0.39) EP300CREBBPMTHFD2
SCHEMBL22615482 0.79 NAMPT (0.38) CHRNA7MTHFD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220227789-A1 NOVEL INDOLIZINE-2-CARBOXAMIDES ACTIVE AGAINST THE HEPATITIS B VIRUS (HBV) AICURIS GMBH & CO. KG (DE) 2022-07-21 — — US disclosed
EP-3962913-A1 NOVEL INDOLIZINE-2-CARBOXAMIDES ACTIVE AGAINST THE HEPATITIS B VIRUS (HBV) AiCuris GmbH & Co. KG (DE) 2022-03-09 — — EP disclosed
WO-2020221824-A1 NOVEL INDOLIZINE-2-CARBOXAMIDES ACTIVE AGAINST THE HEPATITIS B VIRUS (HBV) AICURIS GMBH & CO. KG (DE) 2020-11-05 — — WO disclosed
WO-2020221824-A1 NOVEL INDOLIZINE-2-CARBOXAMIDES ACTIVE AGAINST THE HEPATITIS B VIRUS (HBV) AICURIS GMBH & CO. KG (DE) 2020-11-05 — — WO 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-20220227789-A1 NOVEL INDOLIZINE-2-CARBOXAMIDES ACTIVE AGAINST THE HEPATITIS B VIRUS (HBV) HCCS, CDK2, BRD4 CHRNA7 4715/4885EP300 1008/4885CREBBP 344/4885

“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.

Send feedback