SCHEMBL1122234

SCHEMBL1122234

CONc1cccc(OC)c1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.56
MEN1 O00255 3/20 0.56
MAPT P10636 2/20 0.56
MAPK1 P28482 1/20 0.56
POLB P06746 1/20 0.56
TP53 P04637 2/20 0.56
TSHR P16473 1/20 0.56
RXFP1 Q9HBX9 1/20 0.56
NPC1 O15118 3/20 0.54
RAB9A P51151 3/20 0.54
ALDH1A1 P00352 2/20 0.54
NLRP3 Q96P20 1/20 0.54
PKM P14618 1/20 0.54
SMN1; SMN2 Q16637 1/20 0.54
RAPGEF4 Q8WZA2 1/20 0.53
MTNR1A P48039 2/20 0.53
MTNR1B P49286 2/20 0.53
IDO1 P14902 1/20 0.53
SIGMAR1 Q99720 1/20 0.53
MITF O75030 1/20 0.51

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
SCHEMBL11639364 0.84 MEN1 (0.42) KMT2AMEN1MAPTMAPK1POLB
SCHEMBL5311132 0.83 KMT2A (0.56) KMT2AMEN1MAPTMAPK1POLB
SCHEMBL1085867 0.82 MEN1 (0.71) KMT2AMEN1MAPTMAPK1POLB
SCHEMBL8326648 0.82 KMT2A (0.60) KMT2AMEN1MAPTMAPK1POLB
SCHEMBL10436614 0.80 ALDH1A1 (0.53) KMT2AMEN1MAPTMAPK1POLB
SCHEMBL2371613 0.80 KMT2A (0.50) KMT2AMEN1MAPTMAPK1POLB
SCHEMBL13852338 0.80 KMT2A (0.50) KMT2AMEN1MAPTMAPK1POLB
SCHEMBL30543838 0.80 KMT2A (0.63) KMT2AMEN1MAPTMAPK1POLB
SCHEMBL13302353 0.80 MEN1 (0.69) KMT2AMEN1MAPTMAPK1POLB
SCHEMBL361514 0.80 KMT2A (0.63) KMT2AMEN1MAPTMAPK1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104507943-A Substituted tricyclic compounds as FGFR inhibitors INCYTE CORP 2015-04-08 CN disclosed
US-8288549-B2 Glycine B antagonist MERZ PHARMA GMBH & CO. KGAA (DE) 2012-10-16 US disclosed
US-20110190342-A1 GLYCINE B ANTAGONIST HENRICH MARKUS 2011-08-04 US disclosed
EP-1831184-B1 PYRAZINES AND PYRIDINES AND DERIVATIVES THEREOF AS THERAPEUTIC COMPOUNDS WELLCOME TRUST LTD (GB) 2011-02-09 EP disclosed
US-7737152-B2 6-carboaryl-oxy-pyrazin-2-yl-carboaryl-amines and compositions comprising said compounds THE WELLCOME TRUST LIMITED (GB) 2010-06-15 US disclosed
US-20080015191-A1 Pyrazines and Pyridines and Derivatives Thereof as Therapeutic Compounds THE WELLCOME TRUST LIMITED (UK) 2008-01-17 US disclosed
EP-1831184-A2 PYRAZINES AND PYRIDINES AND DERIVATIVES THEREOF AS THERAPEUTIC COMPOUNDS The Wellcome Trust Limited (GB) 2007-09-12 EP disclosed
WO-2006067466-A2 PYRAZINES AND PYRIDINES AND DERIVATIVES THEREOF AS THERAPEUTIC COMPOUNDS THE WELLCOME TRUST LIMITED (GB) 2006-06-29 WO disclosed
US-6229055-B1 SYNTHESIS OF FLUORINATED RESORCINOL WHICH IS USEFUL IN THE PREPARATION OF FLUORINATED FLUORESCEIN AND RHODOL DYES SUITABLE FOR USE AS TRACERS, LABELS, OR INTERMEDIATES MOLECULAR PROBES, INC. 2001-05-08 US disclosed
US-6162931-A Fluorinated xanthene derivatives MOLECULAR PROBES, INC. (US) 2000-12-19 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 (2 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-20080015191-A1 Pyrazines and Pyridines and Derivatives Thereof as Therapeutic Compounds BRAF, RAF1, BCOR KMT2A 2377/4885MEN1 2600/4885MAPT 4774/4885
US-20110190342-A1 GLYCINE B ANTAGONIST GRIN2B, GLRB, GRIN2A KMT2A 1700/4885MEN1 808/4885MAPT 1267/4885

“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.