SCHEMBL10411556

SCHEMBL10411556

CCCc1nc2c(OCc3ccccc3)ccc(C)c2[nH]1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FFAR4 Q5NUL3 1/20 0.41
▸ MAPT P10636 1/20 0.40
▸ MAPK1 P28482 1/20 0.40
▸ TDP1 Q9NUW8 1/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ PRMT5 O14744 2/20 0.40
▸ STAT3 P40763 1/20 0.39
▸ HTT P42858 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ ADORA3 P0DMS8 2/20 0.39
▸ ADORA2A P29274 2/20 0.39
▸ ADORA1 P30542 2/20 0.39
▸ BRD4 O60885 2/20 0.39
▸ ATP4A P20648 1/20 0.38
▸ ATP4B P51164 1/20 0.38
▸ PDE9A O76083 1/20 0.37
▸ PDE1A P54750 1/20 0.37
▸ PDE1B Q01064 1/20 0.37
▸ PDE1C Q14123 1/20 0.37
▸ PDE5A O76074 1/20 0.37

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
SCHEMBL10411402 0.91 FFAR4 (0.42) FFAR4MAPTMAPK1TDP1L3MBTL1
SCHEMBL10411557 0.90 FFAR4 (0.41) FFAR4MAPTMAPK1TDP1L3MBTL1
SCHEMBL10411924 0.88 PDE9A (0.43) MAPTMAPK1TDP1L3MBTL1PRMT5
SCHEMBL10412617 0.81 ABCB1 (0.45) ADORA3
SCHEMBL10411403 0.81 PDE4A (0.43) FFAR4MAPTMAPK1TDP1L3MBTL1
SCHEMBL2530644 0.80 PDE9A (0.49) MAPK1TDP1HTTSMN1; SMN2PDE9A
SCHEMBL10410753 0.80 PRMT5 (0.55) MAPTMAPK1TDP1L3MBTL1PRMT5
SCHEMBL10411926 0.78 — —
SCHEMBL6376433 0.74 PDE4A (0.45) MAPTSMN1; SMN2PDE4APDE4BPDE4C
SCHEMBL9007521 0.72 PARP1 (0.41) MAPTMAPK1TDP1L3MBTL1PDE4A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4925853-A Antiinflammatory, antiallergens, antiulcer agents BEECHAM GROUP PLC (GB) 1990-05-15 — — US disclosed
EP-0178413-A1 Benzimidazoles BEECHAM GROUP PLC (GB) 1986-04-23 — — EP disclosed
Send feedback