SCHEMBL6747555

SCHEMBL6747555

COCN1c2cc(C(=O)O)ccc2Sc2nccnc21

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 2/20 0.44
MAPT P10636 1/20 0.40
LMNA P02545 2/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
POLB P06746 1/20 0.37
KDM5A P29375 1/20 0.35
KDM4C Q9H3R0 1/20 0.35
KDM5B Q9UGL1 1/20 0.35
HRH1 P35367 3/20 0.35
ALDH1A1 P00352 1/20 0.35
ICAM1 P05362 2/20 0.35
TP53 P04637 1/20 0.35
THRB P10828 1/20 0.34

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
SCHEMBL8315505 0.92 HDAC6 (0.45) HDAC6MAPTLMNAMEN1KMT2A
SCHEMBL6747463 0.91 HDAC6 (0.44) HDAC6MAPTLMNAMEN1KMT2A
SCHEMBL6745834 0.90 HDAC6 (0.43) HDAC6LMNAMEN1KMT2APOLB
SCHEMBL8319484 0.89 HDAC6 (0.42) HDAC6MAPTPOLBICAM1
SCHEMBL8319481 0.89 HDAC6 (0.42) HDAC6MAPTPOLBICAM1
SCHEMBL6750180 0.89 HDAC6 (0.43) HDAC6MAPTLMNAMEN1KMT2A
SCHEMBL6747320 0.88 HDAC6 (0.57) HDAC6TP53
SCHEMBL6750178 0.84 LMNA (0.39) MAPTLMNAMEN1KMT2APOLB
SCHEMBL6746495 0.82 HDAC6 (0.43) HDAC6MAPTMEN1KMT2AHRH1
SCHEMBL6747666 0.82 KDM4E (0.40) HDAC6LMNAKMT2AHRH1ALDH1A1

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 HDAC6 1953/4885MAPT 1257/4885LMNA 4878/4885

“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.