SCHEMBL9764859

SCHEMBL9764859

CCNC(=O)N(O)Cc1ccc2c(c1)sc1ccccc12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.39
RAB9A P51151 4/20 0.39
LMNA P02545 3/20 0.39
MAPT P10636 3/20 0.39
NPC1 O15118 3/20 0.39
HPGD P15428 3/20 0.39
GLA P06280 1/20 0.39
ALOX15 P16050 1/20 0.39
TSHR P16473 1/20 0.39
ALOX12 P18054 1/20 0.39
GAA P10253 1/20 0.38
ALOX5 P09917 1/20 0.38
KDM4E B2RXH2 3/20 0.37
HTT P42858 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
GABRP O00591 1/20 0.37
GABRD O14764 1/20 0.37
GABRA1 P14867 1/20 0.37
GABRB1 P18505 1/20 0.37
GABRG2 P18507 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
SCHEMBL9764878 0.87 ALDH1A1 (0.39) ALDH1A1RAB9ALMNAMAPTNPC1
SCHEMBL9764906 0.83 ALOX5 (0.45) ALDH1A1RAB9ALMNAMAPTNPC1
SCHEMBL9764873 0.78 ECE1 (0.47) ALDH1A1RAB9ALMNANPC1TSHR
SCHEMBL9764834 0.78 LMNA (0.47) ALDH1A1RAB9ALMNAMAPTNPC1
SCHEMBL2396236 0.74 CYP2A6 (0.48) RAB9AALOX5
SCHEMBL9764870 0.73 ALDH1A1 (0.38) ALDH1A1RAB9ALMNAMAPTNPC1
SCHEMBL9764820 0.72 ALOX5 (0.45) ALDH1A1RAB9ALMNAMAPTNPC1
Ammonia Solution, Strong SCHEMBL9764837 0.72 ALDH1A1 (0.39) ALDH1A1RAB9ALMNAMAPTNPC1
SCHEMBL25721910 0.72 ALDH1A1 (0.50) ALDH1A1RAB9ALMNAMAPTNPC1
SCHEMBL12436066 0.71 GPR3 (0.54) ALDH1A1RAB9ALMNAMAPTNPC1

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
EP-0422079-A4 TRICYCLIC LIPOXYGENASE INHIBITING COMPOUNDS, COMPOSITIONS, METHODS OF USE 1991-08-21 EP disclosed
EP-0422079-A1 TRICYCLIC LIPOXYGENASE INHIBITING COMPOUNDS, COMPOSITIONS, METHODS OF USE ABBOTT LABORATORIES (US) 1991-04-17 EP disclosed
WO-1989012636-A1 TRICYCLIC LIPOXYGENASE INHIBITING COMPOUNDS, COMPOSITIONS, METHODS OF USE ABBOTT LABORATORIES (US) 1989-12-28 WO disclosed
EP-0346939-A1 Tricyclic lipoxygenase inhibiting compounds ABBOTT LABORATORIES (US) 1989-12-20 EP disclosed
US-4822811-A Carbazole lipoxygenase inhibiting compounds, compositions and use ABBOTT LABORATORIES (US) 1989-04-18 US disclosed