SCHEMBL10510092

SCHEMBL10510092

COc1ccc(C=Cc2ccc3c(=O)n(CCCN(C)C)ncc3c2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FLT3 P36888 5/20 0.43
▸ MAOA P21397 2/20 0.42
▸ MAOB P27338 2/20 0.42
▸ SMN1; SMN2 Q16637 2/20 0.41
▸ LMNA P02545 1/20 0.41
▸ KAT2B Q92831 2/20 0.41
▸ EGFR P00533 1/20 0.39
▸ PDGFRB P09619 1/20 0.39
▸ PDGFRA P16234 1/20 0.39
▸ APP P05067 2/20 0.39
▸ HRH3 Q9Y5N1 2/20 0.39
▸ NPBWR1 P48145 1/20 0.38
▸ ROCK2 O75116 1/20 0.38
▸ KCNH2 Q12809 1/20 0.37
▸ MCHR1 Q99705 1/20 0.37
▸ ALDH1A1 P00352 1/20 0.37
▸ TP53 P04637 1/20 0.37
▸ MAPT P10636 1/20 0.37
▸ HPGD P15428 1/20 0.37
▸ CASP1 P29466 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
SCHEMBL10510083 1.00 FLT3 (0.43) FLT3MAOAMAOBSMN1; SMN2LMNA
Bromide SCHEMBL10581709 0.99 FLT3 (0.42) FLT3MAOAMAOBSMN1; SMN2LMNA
Bromide SCHEMBL10581715 0.99 FLT3 (0.42) FLT3MAOAMAOBSMN1; SMN2LMNA
Bromide SCHEMBL10583382 0.96 MAOA (0.43) FLT3MAOAMAOBSMN1; SMN2LMNA
Bromide SCHEMBL10583385 0.96 MAOA (0.43) FLT3MAOAMAOBSMN1; SMN2LMNA
SCHEMBL10581084 0.94 KAT2B (0.42) FLT3MAOAMAOBSMN1; SMN2LMNA
SCHEMBL10581087 0.94 KAT2B (0.42) FLT3MAOAMAOBSMN1; SMN2LMNA
Bromide SCHEMBL10582244 0.93 KAT2B (0.41) FLT3MAOAMAOBSMN1; SMN2LMNA
Bromide SCHEMBL10582253 0.93 KAT2B (0.41) FLT3MAOAMAOBSMN1; SMN2LMNA
SCHEMBL10509576 0.88 KCNH2 (0.41) FLT3LMNAHRH3KCNH2MCHR1

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
US-4665181-A Anti-inflammatory phthalazinones PENNWALT CORPORATION (US) 1987-05-12 — — US claimed
EP-0164593-B1 ANTI-INFLAMMATORY PHTHALAZINONES FISONS CORPORATION (US) 1989-11-15 — — EP disclosed
EP-0309765-A2 1(2H)-Phthalazinones as cytoprotective agents FISONS CORPORATION (US) 1989-04-05 — — EP disclosed
US-4769369-A Anti-allergy 1(2H)-phthalazinones PENNWALT CORPORATION (US) 1988-09-06 — — US disclosed
US-4665181-A Anti-inflammatory phthalazinones PENNWALT CORPORATION (US) 1987-05-12 — — US disclosed
EP-0164593-A1 Anti-inflammatory phthalazinones FISONS CORPORATION (US) 1985-12-18 — — EP disclosed
Send feedback