SCHEMBL6750499

SCHEMBL6750499

COCN1c2cc(Cn3cnc4c(Br)ncnc43)ccc2Sc2nccnc21

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 4/20 0.36
HDAC6 Q9UBN7 1/20 0.35
DAPK1 P53355 1/20 0.34
HRH4 Q9H3N8 1/20 0.34
HPGD P15428 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
SCHEMBL6749417 0.89 FGFR1 (0.42) HDAC6DAPK1HPGD
SCHEMBL6745579 0.89 DAPK1 (0.34) PDE10AHDAC6DAPK1HRH4HPGD
SCHEMBL6745829 0.88 DAPK1 (0.34) PDE10AHDAC6DAPK1HRH4HPGD
SCHEMBL6749471 0.87 DAPK1 (0.33) PDE10AHDAC6DAPK1HRH4HPGD
SCHEMBL6752024 0.86 PDE10A (0.54) PDE10AHRH4
SCHEMBL6749165 0.86 HDAC6 (0.37) HDAC6DAPK1
SCHEMBL6747470 0.85 HDAC6 (0.33) PDE10AHDAC6DAPK1HPGD
SCHEMBL6747701 0.85 PDE10A (0.33) PDE10AHDAC6DAPK1HPGD
SCHEMBL6747287 0.84 FGFR1 (0.32) PDE10AHDAC6DAPK1HPGD
SCHEMBL6745469 0.84 HDAC6 (0.32) PDE10AHDAC6DAPK1HPGD

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-20040092737-A1 Benzopiperidine derivatives EISAI CO., LTD. 2004-05-13 US disclosed
US-6518423-B1 These compounds are useful as drugs efficacious in the prevention and treatment of these various inflammatory diseases and immunologic diseases, such as rheumatoid arthritis, atopic dermatitis, psoriasis, asthma, and EISAI CO., LTD. (JP) 2003-02-11 US disclosed
EP-0934941-A1 BENZOPIPERIDINE DERIVATIVES Eisai Co., Ltd. (JP) 1999-08-11 EP 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-20040092737-A1 Benzopiperidine derivatives HLA-DRB1, HRH1, HRH2 PDE10A 2098/4885HDAC6 1953/4885DAPK1 1305/4885

“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.