SCHEMBL11227476

SCHEMBL11227476

CN1C(C(=O)Nc2coc3cc4c(cc3c2=O)CCC4)C(=O)c2ccccc2S1(=O)=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.46
▸ LMNA P02545 5/20 0.39
▸ RECQL P46063 1/20 0.39
▸ SMN1; SMN2 Q16637 4/20 0.35
▸ MAPT P10636 2/20 0.35
▸ KMT2A Q03164 5/20 0.34
▸ MEN1 O00255 4/20 0.33
▸ HPGD P15428 3/20 0.33
▸ MAOB P27338 1/20 0.33
▸ ADRA1D P25100 1/20 0.33
▸ ADRA1A P35348 1/20 0.33
▸ ADRA1B P35368 1/20 0.33
▸ ADRB2 P07550 1/20 0.33
▸ MAPK1 P28482 1/20 0.32
▸ TSHR P16473 1/20 0.30
▸ HTT P42858 1/20 0.30
▸ KDM4E B2RXH2 1/20 0.30
▸ ESR1 P03372 1/20 0.30
▸ POLB P06746 1/20 0.30
▸ ALOX15 P16050 1/20 0.30

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
SCHEMBL11234155 0.87 ALDH1A1 (0.52) ALDH1A1LMNASMN1; SMN2KMT2AMEN1
SCHEMBL11227836 0.85 ALDH1A1 (0.53) ALDH1A1MAOB
SCHEMBL11238856 0.84 ALDH1A1 (0.51) ALDH1A1MAPTKMT2AMEN1MAOB
SCHEMBL11235876 0.84 ALDH1A1 (0.48) ALDH1A1LMNAKMT2AMEN1HPGD
SCHEMBL11238000 0.82 ALDH1A1 (0.46) ALDH1A1LMNASMN1; SMN2MAPTKMT2A
SCHEMBL11232506 0.78 ALDH1A1 (0.50) ALDH1A1LMNASMN1; SMN2MAPTKMT2A
SCHEMBL11245007 0.78 ALDH1A1 (0.52) ALDH1A1LMNASMN1; SMN2MAPTKMT2A
SCHEMBL11240239 0.77 ALDH1A1 (0.48) ALDH1A1LMNASMN1; SMN2MAPTKMT2A
SCHEMBL11224073 0.74 MAOB (0.43) ALDH1A1MAOB
SCHEMBL11622970 0.71 ALDH1A1 (0.59) ALDH1A1LMNASMN1; SMN2MAPTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4327091-A ANTIINFLAMMATORY AGENTS CIBA-GEIGY CORPORATION (US) 1982-04-27 — — US claimed
EP-0003360-B1 AZATHIANAPHTHALENE DERIVATIVES, PROCESS FOR THEIR PREPARATION, PHARMACEUTICAL PREPARATIONS CONTAINING THEM AND THEIR UTILISATION CIBA-GEIGY AG (CH) 1981-12-30 — — EP claimed
US-4213980-A ANTIINFLAMMATORY AGENTS CIBA-GEIGY CORPORATION (US) 1980-07-22 — — US claimed
US-4327091-A ANTIINFLAMMATORY AGENTS CIBA-GEIGY CORPORATION (US) 1982-04-27 — — US disclosed
US-4213980-A ANTIINFLAMMATORY AGENTS CIBA-GEIGY CORPORATION (US) 1980-07-22 — — US disclosed
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