SCHEMBL10467940

SCHEMBL10467940

O=C(c1ccc(Cn2cnc3cnccc32)cc1)N1CCOCC1

nearest known ligand 0.61

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.48
HRH3 Q9Y5N1 7/20 0.48
MGLL Q99685 1/20 0.46
PHGDH O43175 1/20 0.46
NAMPT P43490 2/20 0.46
GAA P10253 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.45
IDO1 P14902 1/20 0.45
TDO2 P48775 1/20 0.45
CYP3A4 P08684 1/20 0.44
CYP2C19 P33261 1/20 0.44
ALDH1A1 P00352 1/20 0.44
LMNA P02545 1/20 0.44
MAPT P10636 1/20 0.44

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
SCHEMBL10468257 0.91 HPGD (0.48) HPGDHRH3MGLLPHGDHNAMPT
SCHEMBL10468250 0.80 TP53 (0.59)
SCHEMBL10470105 0.79 HPGD (0.49) HPGDHRH3MGLLPHGDHGAA
SCHEMBL9694201 0.79 HDAC6 (0.50) SMN1; SMN2LMNA
SCHEMBL23498232 0.78 GAA (0.58) HPGDHRH3PHGDHNAMPTGAA
SCHEMBL9390726 0.76 HDAC6 (0.56) IDO1MAPT
SCHEMBL10467889 0.74 SMN1; SMN2 (0.59) NAMPTSMN1; SMN2LMNA
SCHEMBL13508711 0.73 CYP11B1 (0.65) GAASMN1; SMN2LMNA
SCHEMBL15754906 0.72 PHGDH (0.66) HPGDPHGDHNAMPTSMN1; SMN2CYP3A4
SCHEMBL27441902 0.72 LTA4H (0.46) SMN1; SMN2ALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4804658-A PLATELET-ACTIVATING FACTOR ANTAGONISTS G. D. SEARLE & CO. (US) 1989-02-14 US claimed
EP-0260613-A2 Imidazopyridine derivatives, their preparation and their use as PAF-antagonists G.D. Searle & Co. (US) 1988-03-23 EP claimed
US-4962106-A Treating platelet activating factor mediated disorders G. D. SEARLE & CO. (US) 1990-10-09 US disclosed
US-4804658-A PLATELET-ACTIVATING FACTOR ANTAGONISTS G. D. SEARLE & CO. (US) 1989-02-14 US disclosed
EP-0260613-A2 Imidazopyridine derivatives, their preparation and their use as PAF-antagonists G.D. Searle & Co. (US) 1988-03-23 EP disclosed