SCHEMBL6245678

SCHEMBL6245678

CCCC(C)(F)c1nc[nH]c(=O)c1C

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 3/20 0.42
▸ PARP1 P09874 7/20 0.35
▸ PDPK1 O15530 4/20 0.34
▸ KDM4E B2RXH2 2/20 0.33
▸ GAA P10253 2/20 0.33
▸ LMNA P02545 1/20 0.33
▸ ADORA1 P30542 2/20 0.32
▸ CYP1A2 P05177 1/20 0.32
▸ TMIGD3 P0DMS9 1/20 0.32
▸ CYP2C9 P11712 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ CHEK1 O14757 1/20 0.31
▸ PIM1 P11309 1/20 0.31
▸ RPS6KA3 P51812 1/20 0.31
▸ HSD17B10 Q99714 2/20 0.31
▸ RAB9A P51151 1/20 0.31
▸ KDM5B Q9UGL1 1/20 0.31
▸ ADORA3 P0DMS8 1/20 0.31
▸ PDE4A P27815 1/20 0.31
▸ ADORA2A P29274 1/20 0.31

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
SCHEMBL6244790 0.91 HPGD (0.41) HPGDPARP1PDPK1KDM4EGAA
SCHEMBL6246540 0.87 HPGD (0.45) HPGDPARP1PDPK1KDM4EGAA
SCHEMBL6243820 0.83 HPGD (0.41) HPGDPARP1PDPK1ADORA1CYP1A2
SCHEMBL6245235 0.80 HPGD (0.50) HPGDPARP1PDPK1ALDH1A1CHEK1
SCHEMBL9582021 0.78 HPGD (0.47) HPGDPARP1PDPK1ALDH1A1CHEK1
SCHEMBL9581310 0.75 HPGD (0.44) HPGDPARP1PDPK1GAAALDH1A1
SCHEMBL6246479 0.75 HPGD (0.40) HPGDPARP1PDPK1ADORA1CYP1A2
SCHEMBL6243750 0.70 HPGD (0.44) HPGDPARP1PDPK1ADORA1CYP1A2
SCHEMBL6245597 0.70 PDE2A (0.33) HPGD
SCHEMBL22139827 0.66 HPGD (0.50) HPGDPARP1PDPK1ALDH1A1CHEK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1065202-B1 6-(ALPHA-FLUOROALKYL)-4-PYRIMIDONES AND PROCESS FOR PRODUCING THE SAME UBE INDUSTRIES (JP) 2005-08-03 — — EP claimed
US-6340757-B1 SYNTHETIC INTERMEDIATE FOR AMINOPYRIMIDINE DERIVATIVES WHICH ARE USEFUL AS ACARICIDES, FUNGICIDES OR NEMATOCIDES, AND PROCESSES FOR PRODUCING THE SAME. UBE INDUSTRIES, LTD. (JP) 2002-01-22 — — US claimed
EP-1065202-A1 6-(ALPHA-FLUOROALKYL)-4-PYRIMIDONES AND PROCESS FOR PRODUCING THE SAME UBE INDUSTRIES LIMITED (JP) 2001-01-03 — — EP claimed
EP-1065202-B1 6-(ALPHA-FLUOROALKYL)-4-PYRIMIDONES AND PROCESS FOR PRODUCING THE SAME UBE INDUSTRIES (JP) 2005-08-03 — — EP disclosed
US-6340757-B1 SYNTHETIC INTERMEDIATE FOR AMINOPYRIMIDINE DERIVATIVES WHICH ARE USEFUL AS ACARICIDES, FUNGICIDES OR NEMATOCIDES, AND PROCESSES FOR PRODUCING THE SAME. UBE INDUSTRIES, LTD. (JP) 2002-01-22 — — US disclosed
EP-1065202-A1 6-(ALPHA-FLUOROALKYL)-4-PYRIMIDONES AND PROCESS FOR PRODUCING THE SAME UBE INDUSTRIES LIMITED (JP) 2001-01-03 — — EP disclosed
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