SCHEMBL29953732

SCHEMBL29953732

COc1cc(B2OC(C)(C)C(C)(C)O2)cc(OC)c1C(=O)N[C@@H]1C[C@@H]1F

nearest known ligand 0.35

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HCRTR1 O43613 8/20 0.35
MEN1 O00255 1/20 0.34
PKM P14618 1/20 0.34
KMT2A Q03164 1/20 0.34
DGAT1 O75907 1/20 0.33
HCRTR2 O43614 1/20 0.33
NR1I2 O75469 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
SCHEMBL29793578 0.93 SIK1 (0.36) HCRTR1
SCHEMBL29953961 0.79 POLB (0.39) MEN1PKMKMT2A
SCHEMBL21591205 0.79 SIK1 (0.46) MEN1PKMKMT2A
SCHEMBL21593294 0.78 ALDH1A1 (0.42) MEN1PKMKMT2A
SCHEMBL29954073 0.77 FAAH (0.42) HCRTR1HCRTR2
SCHEMBL22491269 0.76 CSF1R (0.38) DGAT1NR1I2
SCHEMBL31313278 0.75 SIK1 (0.36)
SCHEMBL26110064 0.75 CYP3A4 (0.42) KMT2ADGAT1NR1I2
SCHEMBL20562111 0.75 CA1 (0.44) PKMDGAT1NR1I2
SCHEMBL31313385 0.75 SIK1 (0.33)

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-12391679-B2 Benzamide-substituted bicyclic imidazo- and pyrazolo-fused -pyridine, -pyrimide, and -pyridazine compounds for treatment of inflammatory diseases ONCO3R THERAPEUTICS BV (BE) 2025-08-19 US disclosed
EP-3976189-B1 NOVEL COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS THEREOF FOR THE TREATMENT OF DISEASES GALAPAGOS NV (BE) 2024-07-03 EP disclosed
US-20220340548-A1 NOVEL COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS THEREOF FOR THE TREATMENT OF DISEASES GALAPAGOS NV (BE) 2022-10-27 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-20220340548-A1 NOVEL COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS THEREOF FOR THE TREATMENT OF DISEASES IL1B, IL1A, IL36G HCRTR1 903/4885MEN1 1419/4885PKM 2975/4885
US-12391679-B2 Benzamide-substituted bicyclic imidazo- and pyrazolo-fused -pyridine, -pyrimide, and -pyridazine compounds for treatment of inflammatory diseases IL5, IL15, IL1A HCRTR1 1679/4885MEN1 2969/4885PKM 1461/4885

“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.