SCHEMBL12836878

SCHEMBL12836878

CCNc1cc2oc3cc(=N)c(C)cc-3c(-c3ccccc3C(=O)N(C)CCO)c2cc1C

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ABCB1 P08183 1/20 0.35
▸ USP2 O75604 2/20 0.34
▸ CFTR P13569 1/20 0.34
▸ PAX8 Q06710 1/20 0.34
▸ ATM Q13315 1/20 0.34
▸ GOPC Q9HD26 1/20 0.34
▸ MAPT P10636 3/20 0.33
▸ MEN1 O00255 3/20 0.33
▸ KMT2A Q03164 3/20 0.33
▸ HPGD P15428 2/20 0.33
▸ BLM P54132 2/20 0.33
▸ KDM4E B2RXH2 2/20 0.33
▸ CYP3A4 P08684 1/20 0.33
▸ THRB P10828 1/20 0.33
▸ ALOX15 P16050 1/20 0.33
▸ CASP1 P29466 1/20 0.33
▸ BRCA1 P38398 1/20 0.33
▸ HTT P42858 1/20 0.33
▸ RECQL P46063 1/20 0.33
▸ CASP7 P55210 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
SCHEMBL14078007 0.88 MEN1 (0.32) ABCB1USP2MAPTMEN1KMT2A
SCHEMBL13770605 0.88 ABCB1 (0.35) ABCB1USP2CFTRPAX8ATM
SCHEMBL13770438 0.86 FTO (0.45) ABCB1USP2CFTRPAX8ATM
SCHEMBL14338739 0.84 ABCB1 (0.43) ABCB1USP2CFTRPAX8ATM
SCHEMBL14078004 0.83 KDM4E (0.31) USP2MAPTMEN1KMT2AHPGD
SCHEMBL13770053 0.82 PSMB8 (0.33) ABCB1HSP90AA1
SCHEMBL14045646 0.81 GAA (0.34) ABCB1USP2CFTRPAX8ATM
SCHEMBL22247631 0.80 FTO (0.33) ABCB1USP2CFTRPAX8ATM
SCHEMBL25208865 0.80 KDM4E (0.34) USP2MAPTMEN1KMT2AHPGD
SCHEMBL18258300 0.79 KDM4E (0.34) USP2MAPTMEN1KMT2AHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110054165-A1 XANTHENE DYES BIOSEARCH TECHNOLOGIES, INC. (US) 2011-03-03 — — 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 (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-20110054165-A1 XANTHENE DYES ANXA5, ANTXR2, XPOT ABCB1 56/4885USP2 3296/4885CFTR 3533/4885

“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.

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