SCHEMBL9863754

SCHEMBL9863754

ClCc1cccc(-c2ncco2)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HPGDS O60760 1/20 0.46
▸ LTA4H P09960 1/20 0.41
▸ HCRTR1 O43613 1/20 0.39
▸ HCRTR2 O43614 1/20 0.39
▸ CYP3A4 P08684 1/20 0.39
▸ MAPK1 P28482 1/20 0.37
▸ P2RX7 Q99572 2/20 0.36
▸ ADORA2A P29274 1/20 0.36
▸ ADORA1 P30542 1/20 0.36
▸ TRPM4 Q8TD43 1/20 0.36
▸ PRKCI P41743 1/20 0.34
▸ TSHR P16473 1/20 0.34
▸ NOTUM Q6P988 1/20 0.34
▸ CHRNA7 P36544 1/20 0.34
▸ CHRNA10 Q9GZZ6 1/20 0.34
▸ CHRNA9 Q9UGM1 1/20 0.34
▸ GPR119 Q8TDV5 1/20 0.34
▸ BACE1 P56817 1/20 0.34
▸ BACE2 Q9Y5Z0 1/20 0.34
▸ KCNJ1 P48048 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
SCHEMBL12648428 0.83 NOTUM (0.50) HPGDSLTA4HHCRTR1HCRTR2CYP3A4
SCHEMBL1804513 0.83 PRKCI (0.53) HPGDSLTA4HHCRTR1HCRTR2CYP3A4
SCHEMBL9454674 0.83 HPGDS (0.46) HPGDSLTA4HHCRTR1HCRTR2CYP3A4
SCHEMBL28164766 0.83 HPGDS (0.46) HPGDSLTA4HHCRTR1HCRTR2CYP3A4
SCHEMBL9507339 0.82 HPGDS (0.53) HPGDSLTA4HHCRTR1HCRTR2CYP3A4
SCHEMBL3964365 0.82 HPGDS (0.58) HPGDSLTA4HTRPM4NOTUMCHRNA7
SCHEMBL6221648 0.81 HPGDS (0.44) HPGDSLTA4HHCRTR1HCRTR2CYP3A4
SCHEMBL16383003 0.80 HPGDS (0.43) HPGDSLTA4HHCRTR1HCRTR2CYP3A4
SCHEMBL14983820 0.80 HPGDS (0.43) HPGDSLTA4HHCRTR1HCRTR2CYP3A4
SCHEMBL10366022 0.79 LTA4H (0.50) HPGDSLTA4HCHRNA7CHRNA10CHRNA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5041567-A Human and veterianary medicine; veneral diseases respiratory diseases, bovine mastitis BEECHAM GROUP PLC (GB) 1991-08-20 — — US disclosed
US-4812470-A Antibacterial monic acid derivatives BEECHAM GROUP P.L.C. (GB) 1989-03-14 — — US disclosed
EP-0087953-B1 ANTIBACTERIAL 1-NORMON-2-YL-HETEROCYCLIC COMPOUNDS BEECHAM GROUP PLC (GB) 1988-04-27 — — EP disclosed
EP-0087953-A2 Antibacterial 1-normon-2-yl-heterocyclic compounds BEECHAM GROUP PLC (GB) 1983-09-07 — — EP disclosed
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