SCHEMBL9673401

SCHEMBL9673401

O=C1NC(=O)C2(S1)c1ccccc1-c1ncccc12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDK2 Q15119 2/20 0.43
▸ KMT2A Q03164 3/20 0.42
▸ CYP1A2 P05177 2/20 0.42
▸ CYP2C19 P33261 1/20 0.42
▸ PTPRC P08575 2/20 0.40
▸ CTSL P07711 1/20 0.40
▸ CTSS P25774 1/20 0.40
▸ PTPN13 Q12923 1/20 0.40
▸ GAA P10253 2/20 0.40
▸ MEN1 O00255 2/20 0.40
▸ TDP1 Q9NUW8 2/20 0.40
▸ TDP2 O95551 1/20 0.40
▸ NSD2 O96028 1/20 0.40
▸ ABL1 P00519 1/20 0.40
▸ PLCG1 P19174 1/20 0.40
▸ CES1 P23141 1/20 0.40
▸ PAX8 Q06710 1/20 0.40
▸ RIN1 Q13671 1/20 0.40
▸ THRB P10828 1/20 0.40
▸ BLM P54132 1/20 0.40

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
SCHEMBL9671932 0.84 PDK2 (0.36) PDK2CYP1A2CYP2C19MAPTNPY5R
SCHEMBL9673448 0.82 ITGA4 (0.44) PDK2KMT2AGAAMEN1TDP1
SCHEMBL9671751 0.71 AKR1B1 (0.44) PDK2CYP1A2CYP2C19MAPT
SCHEMBL9672258 0.69 PDK2 (0.44) PDK2KMT2ACYP1A2CYP2C19PTPRC
SCHEMBL9671809 0.69 ITGA4 (0.68) PDK2KMT2ACYP1A2CYP2C19PTPRC
SCHEMBL22424775 0.69 PDK2 (0.54) PDK2KMT2ACYP1A2CYP2C19PTPRC
SCHEMBL18462130 0.67 PTPRC (0.50) PDK2KMT2ACYP1A2CYP2C19PTPRC
SCHEMBL11990868 0.67 PDK2 (0.56) PDK2KMT2ACYP1A2CYP2C19PTPRC
SCHEMBL30322608 0.67 PDK2 (0.56) PDK2KMT2ACYP1A2CYP2C19PTPRC
SCHEMBL9859978 0.66 TDP1 (0.65) PDK2KMT2ACYP1A2CYP2C19PTPRC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0137333-B1 SPIRO-TRICYCLICAROMATIC SUCCINIMIDE DERIVATIVES AS INHIBITORS OF ALDOSE REDUCTASE ALCON LABORATORIES, INC. (US) 1992-12-30 — — EP disclosed
US-5153211-A Enzyme inhibitors ALCON LABORATORIES, INC. (US) 1992-10-06 — — US disclosed
US-5070100-A COMPLICATIONS OF DIABETES ALCON LABORATORIES, INC. (US) 1991-12-03 — — US disclosed
US-4864028-A ANTIDIABETIC AGENTS ALCON LABORATORIES, INC. (US) 1989-09-05 — — US disclosed
US-4717725-A SPIROCYCLIC AROMATIC IMIDES ALCON LABORATORIES, INC. (US) 1988-01-05 — — US disclosed
US-4537892-A ANTIDIABETIC AGENTS ALCON LABORATORIES, INC. (US) 1985-08-27 — — US disclosed
EP-0137333-A2 Spiro-tricyclicaromatic succinimide derivatives as inhibitors of aldose reductase ALCON LABORATORIES, INC. (US) 1985-04-17 — — EP disclosed
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