SCHEMBL10853045

SCHEMBL10853045

C=CCNc1cc(C(=O)OCC)nc2cn[nH]c12

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.40
▸ L3MBTL1 Q9Y468 3/20 0.40
▸ HPGD P15428 3/20 0.40
▸ LMNA P02545 2/20 0.40
▸ TDP1 Q9NUW8 2/20 0.40
▸ KDM4E B2RXH2 2/20 0.40
▸ MEN1 O00255 2/20 0.37
▸ KMT2A Q03164 2/20 0.37
▸ SMN1; SMN2 Q16637 2/20 0.37
▸ CYP1A2 P05177 2/20 0.35
▸ GAA P10253 3/20 0.34
▸ POLB P06746 1/20 0.34
▸ ATM Q13315 1/20 0.34
▸ NPC1 O15118 2/20 0.34
▸ RAB9A P51151 2/20 0.34
▸ DHODH Q02127 1/20 0.34
▸ HTT P42858 1/20 0.34
▸ CTDSP1 Q9GZU7 1/20 0.34
▸ CYP3A4 P08684 1/20 0.33
▸ CYP2D6 P10635 1/20 0.33

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
SCHEMBL10846106 0.81 HPGD (0.37) ALDH1A1L3MBTL1HPGDKDM4EMEN1
SCHEMBL10506617 0.78 SLC2A1 (0.48) ALDH1A1HPGDLMNAKDM4EMEN1
SCHEMBL10844579 0.78 ATM (0.46) ALDH1A1L3MBTL1HPGDTDP1MEN1
SCHEMBL10847979 0.76 ALDH1A1 (0.43) ALDH1A1L3MBTL1MEN1KMT2ASMN1; SMN2
SCHEMBL10509852 0.74 MEN1 (0.44) ALDH1A1L3MBTL1HPGDLMNATDP1
SCHEMBL10840990 0.67 SLC2A1 (0.58) ALDH1A1HPGDKDM4EMEN1KMT2A
SCHEMBL10465572 0.66 L3MBTL1 (0.63) ALDH1A1L3MBTL1HPGDTDP1KDM4E
SCHEMBL26107861 0.66 ALDH1A1 (0.50) ALDH1A1L3MBTL1HPGDLMNAKDM4E
SCHEMBL31347005 0.66 ALDH1A1 (0.50) ALDH1A1L3MBTL1HPGDLMNAKDM4E
SCHEMBL10568215 0.66 SLC2A1 (0.41) ALDH1A1HPGDLMNAKDM4EMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0154220-A2 Pyrazolopyridine derivatives BEECHAM GROUP PLC (GB) 1985-09-11 — — EP claimed
US-4621089-A Pyrazolopyridine derivatives and their use in treating inflammation and allergic conditions BEECHAM GROUP P.L.C. (GB) 1986-11-04 — — US disclosed
EP-0154220-A2 Pyrazolopyridine derivatives BEECHAM GROUP PLC (GB) 1985-09-11 — — EP disclosed
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