SCHEMBL7904344

SCHEMBL7904344

O=C(O)c1cccnc1O.[NaH]

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NAPRT Q6XQN6 3/20 0.64
▸ KDM4E B2RXH2 5/20 0.63
▸ TDP1 Q9NUW8 1/20 0.63
▸ ALDH1A1 P00352 7/20 0.61
▸ L3MBTL1 Q9Y468 2/20 0.61
▸ ALOX15 P16050 2/20 0.61
▸ CYP3A4 P08684 1/20 0.61
▸ MAPT P10636 1/20 0.61
▸ TSHR P16473 1/20 0.61
▸ BLM P54132 1/20 0.61
▸ AGER Q15109 1/20 0.61
▸ NPSR1 Q6W5P4 1/20 0.61
▸ SMN1; SMN2 Q16637 3/20 0.59
▸ LMNA P02545 2/20 0.59
▸ DHODH Q02127 2/20 0.50
▸ ALOX12 P18054 1/20 0.50
▸ KDM6B O15054 1/20 0.50
▸ KDM6A O15550 1/20 0.50
▸ TET3 O43151 1/20 0.50
▸ KDM4A O75164 1/20 0.50

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
SCHEMBL29514689 0.98 NAPRT (0.67) NAPRTKDM4ETDP1ALDH1A1L3MBTL1
SCHEMBL107538 0.98 NAPRT (0.67) NAPRTKDM4ETDP1ALDH1A1L3MBTL1
SCHEMBL10631520 0.96 NAPRT (0.64) NAPRTKDM4ETDP1ALDH1A1L3MBTL1
Hydrochloric Acid SCHEMBL2164505 0.96 NAPRT (0.64) NAPRTKDM4ETDP1ALDH1A1L3MBTL1
Ammonia Solution, Strong SCHEMBL7970150 0.96 NAPRT (0.64) NAPRTKDM4ETDP1ALDH1A1L3MBTL1
Ammonia Solution, Strong SCHEMBL7970154 0.96 NAPRT (0.64) NAPRTKDM4ETDP1ALDH1A1L3MBTL1
Hydrochloric Acid SCHEMBL2164502 0.94 NAPRT (0.62) NAPRTKDM4ETDP1ALDH1A1L3MBTL1
Pyridine SCHEMBL28979292 0.88 NAPRT (0.56) NAPRTKDM4ETDP1ALDH1A1L3MBTL1
SCHEMBL27349912 0.84 NAPRT (0.51) NAPRTKDM4ETDP1ALDH1A1L3MBTL1
SCHEMBL27362220 0.80 NAPRT (0.47) NAPRTKDM4ETDP1ALDH1A1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6200672-B1 METAL SHEET IS COATED WITH A COMPLEX AND/OR SALT OF A RARE EARTH METAL AND ORGANIC COMPOUND, E.G CATECHOL, PYRIDINE-CARBOXYLIC ACID, AND A MATRIX WHICH PHYSICALLY HOLDS THE ABOVE AND HAS ADHESION FOR METAL; CORROSION RESISTANCE NIPPON STEEL CORPORATION (JP) 2001-03-13 — — US disclosed
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