SCHEMBL1949537

SCHEMBL1949537

Cc1ccc(O)c(-c2c[nH]cn2)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 1/20 0.50
HPGD P15428 10/20 0.48
MAPT P10636 9/20 0.46
KMT2A Q03164 7/20 0.46
MEN1 O00255 6/20 0.46
ALOX15 P16050 5/20 0.46
USP2 O75604 2/20 0.46
CYP19A1 P11511 1/20 0.44
CASP3 P42574 3/20 0.43
SENP7 Q9BQF6 3/20 0.43
SENP8 Q96LD8 2/20 0.43
SENP6 Q9GZR1 2/20 0.43
ALDH1A1 P00352 2/20 0.43
POLB P06746 2/20 0.43
SMN1; SMN2 Q16637 2/20 0.43
NPSR1 Q6W5P4 2/20 0.43
HTT P42858 1/20 0.43
NPC1 O15118 4/20 0.41
TRPA1 O75762 1/20 0.41
RAB9A P51151 4/20 0.40

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
SCHEMBL1949938 0.82 GAA (0.41) IDO1HPGDMAPTCYP19A1ALDH1A1
SCHEMBL12676730 0.79 IDO1 (0.50) IDO1HPGDMAPTKMT2AMEN1
SCHEMBL1907091 0.79 IDO1 (0.50) IDO1HPGDMAPTKMT2AMEN1
SCHEMBL28005829 0.77 IDO1 (0.31) IDO1
SCHEMBL12676617 0.76 ALOX5 (0.46) IDO1HPGDMAPTKMT2AMEN1
SCHEMBL1951809 0.76 HPGD (0.38) HPGDMAPTKMT2AMEN1ALOX15
SCHEMBL1502109 0.74 IDO1 (0.47) IDO1HPGDMAPTKMT2AMEN1
SCHEMBL22434766 0.73 ACHE (0.44) HPGDMAPTKMT2AMEN1USP2
SCHEMBL7027339 0.73 TYR (0.43) HPGDMAPTKMT2AMEN1ALDH1A1
SCHEMBL28789387 0.72 HPGD (0.48) IDO1HPGDMAPTKMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9174942-B2 IDO inhibitors NEWLINK GENETICS CORPORATION (US) 2015-11-03 US disclosed
US-9174942-B2 IDO inhibitors NEWLINK GENETICS CORPORATION (US) 2015-11-03 US disclosed
US-9174942-B2 IDO inhibitors NEWLINK GENETICS CORPORATION (US) 2015-11-03 US disclosed
US-20140323740-A1 IDO Inhibitors NEWLINK GENETICS CORPORATION (US) 2014-10-30 US disclosed
US-20140323740-A1 IDO Inhibitors NEWLINK GENETICS CORPORATION (US) 2014-10-30 US disclosed
US-8748469-B2 IDO inhibitors NEWLINK GENETICS CORPORATION (US) 2014-06-10 US disclosed
US-8748469-B2 IDO inhibitors NEWLINK GENETICS CORPORATION (US) 2014-06-10 US disclosed
US-8748469-B2 IDO inhibitors NEWLINK GENETICS CORPORATION (US) 2014-06-10 US disclosed
US-20110136796-A1 IDO Inhibitors NEWLINK GENETICS (US) 2011-06-09 US disclosed
US-20110136796-A1 IDO Inhibitors NEWLINK GENETICS (US) 2011-06-09 US disclosed
US-20110136796-A1 IDO Inhibitors NEWLINK GENETICS (US) 2011-06-09 US disclosed
WO-2009132238-A2 IDO INHIBITORS NEWLINK GENETICS (US) 2009-10-29 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 (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-20140323740-A1 IDO Inhibitors IDO1, IDO2, INMT IDO1 1/4885HPGD 305/4885MAPT 3678/4885
US-20110136796-A1 IDO Inhibitors IDO1, IDO2, INMT IDO1 1/4885HPGD 305/4885MAPT 3678/4885

“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.