SCHEMBL11348571

SCHEMBL11348571

O=C1NC(=O)C2(CCCc3ccc(F)cc32)N1

nearest known ligand 0.83

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
AKR1B1 P15121 2/20 0.67
AKR1B10 O60218 1/20 0.60
MAPT P10636 1/20 0.60
AKR1A1 P14550 1/20 0.60
TSHR P16473 1/20 0.54
TDP1 Q9NUW8 1/20 0.54

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
SCHEMBL10601227 0.91 TSHR (0.65) AKR1B1AKR1B10MAPTAKR1A1TSHR
SCHEMBL11341929 0.82 AKR1B1 (0.67) AKR1B1TSHRTDP1
SCHEMBL448629 0.82 AKR1B1 (0.67) AKR1B1AKR1A1TSHRTDP1
SCHEMBL7867873 0.81 TSHR (0.63) AKR1B1AKR1B10MAPTAKR1A1TSHR
SCHEMBL1395366 0.80 AKR1B1 (1.00) AKR1B1TSHRTDP1
SCHEMBL11338031 0.79 AKR1B1 (0.62) AKR1B1TSHRTDP1
SCHEMBL10604042 0.78 AKR1B1 (0.59) AKR1B1AKR1B10MAPTAKR1A1TSHR
SCHEMBL11152497 0.78 KDM1A (0.44) AKR1B1AKR1B10MAPTAKR1A1
SCHEMBL11334633 0.78 AKR1B1 (0.60) AKR1B1TSHRTDP1
SCHEMBL10608762 0.77 AKR1B1 (0.53) AKR1B1AKR1B10MAPTAKR1A1

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-4282229-A FOR DIABETIC COMPLICATIONS PFIZER INC. (US) 1981-08-04 US disclosed
US-4258054-A ANTIDIABETIC PFIZER INC. (US) 1981-03-24 US disclosed
US-4210756-A Tetrahydroquinoline hydantoins for chronic diabetic complications PFIZER INC. (US) 1980-07-01 US disclosed
US-4209630-A ANTIDIABETIC AGENTS PFIZER INC. (US) 1980-06-24 US disclosed
US-4147795-A ENZYME INHIBITORS PFIZER INC. (US) 1979-04-03 US disclosed
US-4117230-A ANTIDIABETIC AGENTS PFIZER INC. (US) 1978-09-26 US disclosed