SCHEMBL28446989

SCHEMBL28446989

NC(=O)OCc1ncc(F)cn1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.39
▸ APLNR P35414 1/20 0.38
▸ NQO1 P15559 1/20 0.36
▸ GRM5 P41594 3/20 0.35
▸ AOC3 Q16853 3/20 0.34
▸ MAOB P27338 2/20 0.33
▸ PARP10 Q53GL7 2/20 0.33
▸ ALOX15 P16050 1/20 0.32
▸ AGBL2 Q5U5Z8 1/20 0.32
▸ GLA P06280 1/20 0.31
▸ CYP1A2 P05177 1/20 0.31
▸ CYP2D6 P10635 1/20 0.31
▸ PKM P14618 1/20 0.31
▸ SMN1; SMN2 Q16637 1/20 0.31
▸ NPSR1 Q6W5P4 1/20 0.31
▸ NTRK1 P04629 1/20 0.31

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
SCHEMBL28340802 0.81 LMNA (0.39) LMNANQO1PARP10ALOX15GLA
SCHEMBL28846986 0.81 CYP1A2 (0.39) LMNANQO1MAOBALOX15GLA
SCHEMBL28523610 0.79 LMNA (0.38) LMNANQO1PARP10ALOX15GLA
SCHEMBL28896473 0.78 LMNA (0.40) LMNANQO1AOC3PARP10ALOX15
SCHEMBL14639041 0.78 NQO1 (0.39) LMNANQO1PARP10ALOX15CYP1A2
SCHEMBL28846885 0.77 LMNA (0.40) LMNANQO1AOC3PARP10
SCHEMBL19581865 0.76 APLNR (0.33) APLNRAGBL2CYP1A2
SCHEMBL19581868 0.76 APLNR (0.33) APLNRAGBL2CYP1A2
SCHEMBL26970086 0.74 HTT (0.44) APLNRMAOBAGBL2
SCHEMBL28697197 0.71 DGAT1 (0.43) LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111556871-B 1H-pyrazolo [4,3-b ] pyridines as PDE1 inhibitors H.隆德贝克有限公司 2023-07-07 — — CN disclosed
CN-111556871-A 1H-pyrazolo [4,3-b ] pyridines as PDE1 inhibitors H.隆德贝克有限公司 2020-08-18 — — CN disclosed
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