SCHEMBL10508337

SCHEMBL10508337

COc1ccc(/C=C/c2ccc3c(=O)n(-c4ccc(OC)cc4)ncc3c2)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 7/20 0.50
▸ KMT2A Q03164 5/20 0.50
▸ ALDH1A1 P00352 5/20 0.50
▸ HTT P42858 3/20 0.50
▸ NPC1 O15118 2/20 0.50
▸ RAB9A P51151 2/20 0.50
▸ MAPT P10636 2/20 0.50
▸ S1PR4 O95977 1/20 0.50
▸ S1PR1 P21453 1/20 0.50
▸ PAX8 Q06710 1/20 0.50
▸ NPBWR1 P48145 8/20 0.45
▸ POLB P06746 3/20 0.45
▸ MEN1 O00255 4/20 0.45
▸ NPSR1 Q6W5P4 3/20 0.44
▸ MCHR1 Q99705 3/20 0.44
▸ PSMD14 O00487 1/20 0.44
▸ LMNA P02545 3/20 0.44
▸ TSHR P16473 2/20 0.44
▸ HPGD P15428 2/20 0.43
▸ TP53 P04637 1/20 0.43

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
SCHEMBL10508351 1.00 SMN1; SMN2 (0.50) SMN1; SMN2KMT2AALDH1A1HTTNPC1
SCHEMBL10509051 0.94 NPBWR1 (0.53) SMN1; SMN2KMT2AALDH1A1HTTNPC1
SCHEMBL10509058 0.94 NPBWR1 (0.53) SMN1; SMN2KMT2AALDH1A1HTTNPC1
SCHEMBL10507488 0.94 NPBWR1 (0.51) SMN1; SMN2KMT2AALDH1A1HTTNPC1
SCHEMBL10507500 0.94 NPBWR1 (0.51) SMN1; SMN2KMT2AALDH1A1HTTNPC1
SCHEMBL10510131 0.90 PTGS2 (0.49) SMN1; SMN2KMT2AALDH1A1HTTNPC1
SCHEMBL10510119 0.90 PTGS2 (0.49) SMN1; SMN2KMT2AALDH1A1HTTNPC1
SCHEMBL10509004 0.83 NPBWR1 (0.50) SMN1; SMN2KMT2AALDH1A1HTTNPC1
SCHEMBL10509418 0.83 GRM7 (0.47) KMT2AALDH1A1NPC1RAB9AMAPT
SCHEMBL10509429 0.83 GRM7 (0.47) KMT2AALDH1A1NPC1RAB9AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0164593-B1 ANTI-INFLAMMATORY PHTHALAZINONES FISONS CORPORATION (US) 1989-11-15 — — EP 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
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