SCHEMBL6085879

SCHEMBL6085879

[NH]c1cc(N)cc(C(=O)O)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 4/20 0.47
▸ ALDH1A1 P00352 2/20 0.47
▸ LMNA P02545 2/20 0.47
▸ MEN1 O00255 2/20 0.47
▸ KMT2A Q03164 2/20 0.47
▸ DDO Q99489 1/20 0.47
▸ TPMT P51580 3/20 0.44
▸ CA12 O43570 2/20 0.41
▸ CA1 P00915 2/20 0.41
▸ CA2 P00918 2/20 0.41
▸ CA7 P43166 2/20 0.41
▸ CA9 Q16790 2/20 0.41
▸ CA14 Q9ULX7 2/20 0.41
▸ TDP1 Q9NUW8 2/20 0.39
▸ TP53 P04637 2/20 0.39
▸ CA3 P07451 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ SELL P14151 1/20 0.39
▸ HPGD P15428 1/20 0.39
▸ SELP P16109 1/20 0.39

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
SCHEMBL109155 0.83 KDM4E (0.56) KDM4EALDH1A1LMNAMEN1KMT2A
SCHEMBL10803007 0.83 CA12 (0.50) KDM4EALDH1A1LMNAMEN1KMT2A
SCHEMBL344324 0.83 CA12 (0.50) KDM4EALDH1A1LMNATPMTCA12
SCHEMBL2820215 0.83 KDM4E (0.56) KDM4EALDH1A1LMNAMEN1KMT2A
SCHEMBL223304 0.83 KDM4E (0.56) KDM4EALDH1A1LMNAMEN1KMT2A
SCHEMBL1477467 0.80 KDM4E (0.54) KDM4EALDH1A1LMNAMEN1KMT2A
Water SCHEMBL17938300 0.80 KDM4E (0.54) KDM4EALDH1A1LMNAMEN1KMT2A
Water SCHEMBL2806532 0.80 KDM4E (0.54) KDM4EALDH1A1LMNAMEN1KMT2A
SCHEMBL2847323 0.80 KDM4E (0.54) KDM4EALDH1A1LMNAMEN1KMT2A
SCHEMBL613113 0.80 KDM4E (0.54) KDM4EALDH1A1LMNAMEN1KMT2A

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
US-7015223-B1 Substituted polycyclic aryl and heteroaryl 1,2,4-triazinones useful for selective inhibition of the coagulation cascade PHARMACIA CORPORATION (US) 2006-03-21 — — US claimed
US-20040116430-A1 Substituted polycyclic aryl and heteroaryl pyrimidinones useful for selective inhibition of the coagulation cascade PHARMACIA CORPORATION 2004-06-17 — — US claimed
US-6653316-B1 Coronary artery and cerebrovascular diseases PHARMACIA CORPORATION 2003-11-25 — — US claimed
WO-2001087851-A1 SUBSTITUTED POLYCYCLIC ARYL AND HETEROARYL PYRIMIDINONES USEFUL FOR SELECTIVE INHIBITION OF THE COAGULATION CASCADE PHARMACIA CORPORATION (US) 2001-11-22 — — WO claimed
US-7015223-B1 Substituted polycyclic aryl and heteroaryl 1,2,4-triazinones useful for selective inhibition of the coagulation cascade PHARMACIA CORPORATION (US) 2006-03-21 — — US disclosed
US-6870056-B1 Substitituted polycyclic aryl and heteroaryl pyridones useful for selective inhibition of the coagulation cascade PHARMACIA CORPORATION (US) 2005-03-22 — — US disclosed
US-20040116430-A1 Substituted polycyclic aryl and heteroaryl pyrimidinones useful for selective inhibition of the coagulation cascade PHARMACIA CORPORATION 2004-06-17 — — US disclosed
US-6653316-B1 Coronary artery and cerebrovascular diseases PHARMACIA CORPORATION 2003-11-25 — — US disclosed
WO-2001087851-A1 SUBSTITUTED POLYCYCLIC ARYL AND HETEROARYL PYRIMIDINONES USEFUL FOR SELECTIVE INHIBITION OF THE COAGULATION CASCADE PHARMACIA CORPORATION (US) 2001-11-22 — — WO disclosed
WO-2001087842-A1 SUBSTITUTED POLYCYCLIC ARYL AND HETEROARYL PYRIDONES USEFUL FOR SELECTIVE INHIBITION OF THE COAGULATION CASCADE PHARMACIA CORPORATION (US) 2001-11-22 — — WO disclosed
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