SCHEMBL2283172

SCHEMBL2283172

COc1ccc(-c2cc(C(=O)Nc3cccc(F)n3)c3ccccc3n2)cc1OC

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 0.68
KMT2A Q03164 8/20 0.68
ALDH1A1 P00352 7/20 0.68
MAPT P10636 6/20 0.68
MEN1 O00255 6/20 0.68
SMN1; SMN2 Q16637 4/20 0.68
HPGD P15428 4/20 0.66
LMNA P02545 3/20 0.66
POLB P06746 2/20 0.66
DHODH Q02127 2/20 0.66
GAA P10253 2/20 0.64
CA12 O43570 1/20 0.63
CA1 P00915 1/20 0.63
CA2 P00918 1/20 0.63
CA9 Q16790 1/20 0.63
HTT P42858 1/20 0.62
RAB9A P51151 1/20 0.62
CYP3A4 P08684 1/20 0.61
CYP2C9 P11712 1/20 0.61
CYP2C19 P33261 1/20 0.61

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
SCHEMBL2286108 0.88 CYP3A4 (0.69) KDM4EKMT2AALDH1A1MAPTMEN1
SCHEMBL28567496 0.84 CA9 (0.74) KDM4EKMT2AALDH1A1MAPTMEN1
SCHEMBL2285157 0.83 POLB (0.60) KDM4EKMT2AALDH1A1MAPTMEN1
SCHEMBL2286089 0.83 ALDH1A1 (0.62) KDM4EKMT2AALDH1A1MAPTMEN1
SCHEMBL2281123 0.83 MEN1 (0.62) KDM4EKMT2AALDH1A1MAPTMEN1
SCHEMBL19219784 0.83 KDM4E (0.75) KDM4EKMT2AALDH1A1MAPTMEN1
SCHEMBL28574876 0.81 MEN1 (0.75) KDM4EKMT2AALDH1A1MAPTMEN1
SCHEMBL28575804 0.80 KDM4E (0.74) KDM4EKMT2AALDH1A1MAPTMEN1
SCHEMBL28914302 0.80 KDM4E (0.80) KDM4EKMT2AALDH1A1MAPTMEN1
SCHEMBL28568150 0.80 RUVBL1 (0.79) KDM4EKMT2AALDH1A1MAPTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110207773-A1 NOVEL PHENYL-QUINOLINE-CARBOXYLIC ACID PYRIDINE DERIVATIVES USEFUL AS MODULATORS OF NICOTINIC ACETYLCHOLINE RECEPTORS NEUROSEARCH A/S (DK) 2011-08-25 US claimed
US-20110207773-A1 NOVEL PHENYL-QUINOLINE-CARBOXYLIC ACID PYRIDINE DERIVATIVES USEFUL AS MODULATORS OF NICOTINIC ACETYLCHOLINE RECEPTORS NEUROSEARCH A/S (DK) 2011-08-25 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-20110207773-A1 NOVEL PHENYL-QUINOLINE-CARBOXYLIC ACID PYRIDINE DERIVATIVES USEFUL AS MODULATORS OF NICOTINIC ACETYLCHOLINE RECEPTORS CHRNA5, CHRNA10, CHRNA6 KDM4E 2310/4885KMT2A 2052/4885ALDH1A1 1273/4885

“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.