SCHEMBL23124336

SCHEMBL23124336

CC(C)(C)OC(=O)N1CC2CN(c3cccc(N)c3N)CC2C1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 2/20 0.46
HDAC2 Q92769 2/20 0.46
GPR119 Q8TDV5 8/20 0.43
NR1H2 P55055 1/20 0.43
PDE10A Q9Y233 2/20 0.42
USP30 Q70CQ3 1/20 0.41
SMARCA2 P51531 1/20 0.41
SMARCA4 P51532 1/20 0.41
PBRM1 Q86U86 1/20 0.41
OPRM1 P35372 1/20 0.40
OPRD1 P41143 1/20 0.40
OPRK1 P41145 1/20 0.40
OGFRL1 Q5TC84 1/20 0.40
KDM1A O60341 1/20 0.40
NAMPT P43490 1/20 0.40
LIPE Q05469 1/20 0.39

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
SCHEMBL29795670 1.00 HDAC1 (0.46) HDAC1HDAC2GPR119NR1H2PDE10A
SCHEMBL1249642 0.84 SMARCA2 (0.55) GPR119SMARCA2SMARCA4PBRM1NAMPT
SCHEMBL31152780 0.84 SMARCA2 (0.55) GPR119SMARCA2SMARCA4PBRM1NAMPT
SCHEMBL29745366 0.84 ALDH1A1 (0.43) HDAC1HDAC2GPR119NR1H2PDE10A
SCHEMBL23123966 0.84 ALDH1A1 (0.43) HDAC1HDAC2GPR119NR1H2PDE10A
SCHEMBL23123370 0.81 SCN9A (0.43) HDAC1HDAC2GPR119USP30SMARCA2
SCHEMBL29795606 0.81 SCN9A (0.43) HDAC1HDAC2GPR119USP30SMARCA2
SCHEMBL29795605 0.81 SCN9A (0.43) HDAC1HDAC2GPR119USP30SMARCA2
SCHEMBL23123641 0.81 CYP11B2 (0.43) HDAC1HDAC2GPR119NR1H2USP30
SCHEMBL29795285 0.81 CYP11B2 (0.43) HDAC1HDAC2GPR119NR1H2USP30

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-20220380319-A1 SUBSTITUTED BENZIMIDAZOLE CARBOXAMIDES AND THEIR USE IN THE TREATMENT OF MEDICAL DISORDERS BIAL R&D INVEST S A (PT) 2022-12-01 US disclosed
WO-2021055591-A1 SUBSTITUTED BENZIMIDAZOLE CARBOXAMIDES AND THEIR USE IN THE TREATMENT OF MEDICAL DISORDERS BIAL-BioTech Investments, Inc. (US) 2021-03-25 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-20220380319-A1 SUBSTITUTED BENZIMIDAZOLE CARBOXAMIDES AND THEIR USE IN THE TREATMENT OF MEDICAL DISORDERS GAA, GBA1, CLN6 HDAC1 194/4885HDAC2 80/4885GPR119 941/4885

“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.