SCHEMBL6353574

SCHEMBL6353574

Cc1cc(Cl)cc(NC(=O)Cc2ccc(OC3(OC=O)CCCC3C)cc2)c1

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
RORC P51449 2/20 0.39
ALDH1A1 P00352 3/20 0.38
MEN1 O00255 4/20 0.36
KMT2A Q03164 4/20 0.36
MAPT P10636 1/20 0.36
KDM4E B2RXH2 2/20 0.35
TP53 P04637 1/20 0.35
LMNA P02545 1/20 0.34
HTT P42858 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
HPGD P15428 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
RAB9A P51151 1/20 0.34
POLB P06746 1/20 0.34
EPHX2 P34913 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
SCHEMBL6357188 0.94 ALDH1A1 (0.41) RORCALDH1A1MEN1KMT2AMAPT
SCHEMBL6353572 0.84 RORC (0.40) RORCALDH1A1MEN1KMT2AMAPT
SCHEMBL6353570 0.82 RORC (0.40) RORCALDH1A1MEN1KMT2AMAPT
SCHEMBL6357186 0.77 ALDH1A1 (0.41) RORCALDH1A1MEN1KMT2AMAPT
SCHEMBL6358100 0.77 ALDH1A1 (0.40) RORCALDH1A1MEN1KMT2AKDM4E
SCHEMBL6353569 0.76 MAPT (0.40) RORCALDH1A1MEN1KMT2AMAPT
SCHEMBL8861298 0.76 ALDH1A1 (0.46) RORCALDH1A1MEN1KMT2AMAPT
SCHEMBL6362032 0.75 ALDH1A1 (0.41) RORCALDH1A1MEN1KMT2AMAPT
SCHEMBL6543285 0.72 ALDH1A1 (0.44) RORCALDH1A1MEN1KMT2AMAPT
SCHEMBL6358099 0.71 ALDH1A1 (0.39) RORCALDH1A1MEN1KMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050154062-A1 Substituted chiral allosteric hemoglobin modifiers ALLOS THERAPEUTICS, INC. 2005-07-14 US disclosed
US-6894185-B2 Substituted chiral allosteric hemoglobin modifiers Allós Therapeutics, Inc. (US) 2005-05-17 US disclosed
EP-1206442-A4 SUBSTITUTED CHIRAL ALLOSTERIC HEMOGLOBIN MODIFIERS UNIV VIRGINIA COMMONWEALTH (US) 2004-12-29 EP disclosed
US-6486342-B1 Substituted chiral allosteric hemoglobin modifiers VIRGINIA COMMONWEALTH UNIVERSITY 2002-11-26 US disclosed
EP-1206442-A1 SUBSTITUTED CHIRAL ALLOSTERIC HEMOGLOBIN MODIFIERS VIRGINIA COMMONWEALTH UNIVERSITY (US) 2002-05-22 EP disclosed
WO-2001014316-A1 SUBSTITUTED CHIRAL ALLOSTERIC HEMOGLOBIN MODIFIERS VIRGINIA COMMONWEALTH UNIVERSITY (US) 2001-03-01 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-20050154062-A1 Substituted chiral allosteric hemoglobin modifiers HBZ, HBB, HBG2 RORC 310/4885ALDH1A1 4454/4885MEN1 4867/4885

“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.