SCHEMBL27362220

SCHEMBL27362220

Cc1c2cccc1N2.O=C(O)c1cccnc1O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NAPRT Q6XQN6 2/20 0.47
▸ KDM4E B2RXH2 5/20 0.46
▸ TDP1 Q9NUW8 1/20 0.46
▸ ALDH1A1 P00352 6/20 0.45
▸ MAPT P10636 2/20 0.45
▸ CYP3A4 P08684 1/20 0.45
▸ ALOX15 P16050 1/20 0.45
▸ TSHR P16473 1/20 0.45
▸ BLM P54132 1/20 0.45
▸ AGER Q15109 1/20 0.45
▸ NPSR1 Q6W5P4 1/20 0.45
▸ L3MBTL1 Q9Y468 1/20 0.45
▸ MYC P01106 1/20 0.44
▸ LMNA P02545 4/20 0.44
▸ SMN1; SMN2 Q16637 2/20 0.44
▸ DHODH Q02127 2/20 0.43
▸ HDAC6 Q9UBN7 1/20 0.43
▸ ALOX12 P18054 1/20 0.42
▸ HPGD P15428 1/20 0.41
▸ HSD17B10 Q99714 1/20 0.41

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 0.82 NAPRT (0.67) NAPRTKDM4ETDP1ALDH1A1MAPT
SCHEMBL107538 0.82 NAPRT (0.67) NAPRTKDM4ETDP1ALDH1A1MAPT
SCHEMBL7904344 0.80 NAPRT (0.64) NAPRTKDM4ETDP1ALDH1A1MAPT
Ammonia Solution, Strong SCHEMBL7970154 0.80 NAPRT (0.64) NAPRTKDM4ETDP1ALDH1A1MAPT
Ammonia Solution, Strong SCHEMBL7970150 0.80 NAPRT (0.64) NAPRTKDM4ETDP1ALDH1A1MAPT
SCHEMBL10631520 0.80 NAPRT (0.64) NAPRTKDM4ETDP1ALDH1A1MAPT
Hydrochloric Acid SCHEMBL2164505 0.80 NAPRT (0.64) NAPRTKDM4ETDP1ALDH1A1MAPT
SCHEMBL27349912 0.80 NAPRT (0.51) NAPRTKDM4ETDP1ALDH1A1MAPT
Hydrochloric Acid SCHEMBL2164502 0.78 NAPRT (0.62) NAPRTKDM4ETDP1ALDH1A1MAPT
Pyridine SCHEMBL28979292 0.74 NAPRT (0.56) NAPRTKDM4ETDP1ALDH1A1MAPT

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
CN-1057051-A Hydroxyl and alkoxy pyridine derivative PFIZER (US) 1991-12-18 — — CN disclosed
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