SCHEMBL5177626

SCHEMBL5177626

OCCONCc1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.46
THRB P10828 1/20 0.46
HRAS P01112 1/20 0.46
ALDH1A1 P00352 2/20 0.43
RECQL P46063 1/20 0.43
TDP1 Q9NUW8 2/20 0.43
CA2 P00918 4/20 0.42
CA12 O43570 3/20 0.42
ALOX12 P18054 2/20 0.42
CA7 P43166 2/20 0.42
CA14 Q9ULX7 2/20 0.42
HPGD P15428 1/20 0.42
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
CA1 P00915 3/20 0.41
TSHR P16473 1/20 0.41
MAPT P10636 3/20 0.41
POLB P06746 1/20 0.41
GAA P10253 1/20 0.41
CYP3A4 P08684 2/20 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
SCHEMBL14144825 0.85 HRAS (0.41) IDO1THRBHRASALDH1A1TDP1
SCHEMBL12805042 0.83 HRAS (0.42) IDO1THRBHRASALDH1A1TDP1
SCHEMBL15103137 0.83 IDO1 (0.50) IDO1THRBHRASALDH1A1TDP1
SCHEMBL336981 0.81 CA2 (0.47) IDO1THRBHRASALDH1A1TDP1
SCHEMBL8603268 0.79 IDO1 (0.46) IDO1THRBHRASALDH1A1TDP1
SCHEMBL5506614 0.79 KDM4E (0.45) IDO1THRBHRASTDP1CA2
SCHEMBL3043365 0.79 KEAP1 (0.48) HRASRECQLTDP1CA2CA12
SCHEMBL11211785 0.78 PAM (0.48) IDO1THRBHRASCA2CA12
SCHEMBL27315456 0.78 IDO1 (0.53) IDO1RECQLMAPTGAADRD4
SCHEMBL5501337 0.76 ALDH1A1 (0.47) ALDH1A1TDP1HPGDMEN1KMT2A

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-111621002-B Non-ionic waterborne epoxy resin curing agent and preparation method thereof 四川职业技术学院 2022-09-27 CN disclosed
CN-111621002-A Non-ionic waterborne epoxy resin curing agent and preparation method thereof 四川职业技术学院 2020-09-04 CN disclosed
EP-1791835-A2 THIAZOLE DERIVATIVES HAVING VAP-1 INHIBITORY ACTIVITY Astellas Pharma Inc. (JP) 2007-06-06 EP disclosed
EP-1786792-A2 THIAZOLE DERIVATIVES HAVING VAP-1 INHIBITORY ACTIVITY Astellas Pharma Inc. (JP) 2007-05-23 EP disclosed
WO-2006028269-A2 THIAZOLE DERIVATIVES HAVING VAP-1 IHIBITORY ACTIVITY ASTELLAS PHARMA INC. (JP) 2006-03-16 WO disclosed
WO-2006011631-A2 THIAZOLE DERIVATIVES HAVING VAP-1 INHIBITORY ACTIVITY ASTELLAS PHARMA INC. (JP) 2006-02-02 WO disclosed
EP-1608365-A1 METHOD FOR TREATING VASCULAR HYPERPERMEABLE DISEASE Sucampo AG (CH) 2005-12-28 EP disclosed
EP-1587800-A1 THIAZOLE DERIVATIVES AND THEIR USE AS VAP-1 INHIBITORS Astellas Pharma Inc. (JP) 2005-10-26 EP disclosed
WO-2004087138-A1 METHOD FOR TREATING VASCULAR HYPERPERMEABLE DISEASE SUCAMPO AG (CH) 2004-10-14 WO disclosed
WO-2004067521-A1 THIAZOLE DERIVATIVES AND THEIR USE AS VAP-1 INHIBITORS ASTELLAS PHARMA INC. (JP) 2004-08-12 WO disclosed