Nipecotic Acid

Nipecotic Acid

SCHEMBL27460458

C=O.O=C(O)C1CCCNC1

nearest known ligand 0.91

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC6A1 P30531 3/20 0.91
TSHR P16473 2/20 0.91
SLC6A11 P48066 2/20 0.91
SLC6A13 Q9NSD5 2/20 0.91
LMNA P02545 1/20 0.91
SMN1; SMN2 Q16637 1/20 0.91
KMT2A Q03164 2/20 0.61
KDM4E B2RXH2 1/20 0.61
MAPT P10636 1/20 0.61
ATM Q13315 1/20 0.61
CYP2D6 P10635 1/20 0.61
NOS2 P35228 1/20 0.50
GABRA5 P31644 2/20 0.48
GABRB2 P47870 2/20 0.48
GABRP O00591 1/20 0.48
GABRD O14764 1/20 0.48
GABRA1 P14867 1/20 0.48
GABRB1 P18505 1/20 0.48
GABRG2 P18507 1/20 0.48
GABRB3 P28472 1/20 0.48

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
Nipecotic Acid SCHEMBL85677 0.96
(S)-Nipecotic Acid SCHEMBL254683 0.96
Nipecotic Acid SCHEMBL456856 0.96 SLC6A1 (1.00) SLC6A1TSHRSLC6A11SLC6A13LMNA
(R)-Nipecotic Acid SCHEMBL29880539 0.96
(R)-Nipecotic Acid SCHEMBL520075 0.96
Nipecotic Acid SCHEMBL15971488 0.93 SLC6A1 (0.95) SLC6A1TSHRSLC6A11SLC6A13LMNA
Nipecotic Acid SCHEMBL193736 0.93 SLC6A1 (0.95) SLC6A1TSHRSLC6A11SLC6A13LMNA
(R)-Nipecotic Acid SCHEMBL20562073 0.93 SLC6A1 (0.95) SLC6A1TSHRSLC6A11SLC6A13LMNA
Nipecotic Acid SCHEMBL17743427 0.93 SLC6A1 (0.95) SLC6A1TSHRSLC6A11SLC6A13LMNA
(S)-Nipecotic Acid SCHEMBL193735 0.93 SLC6A1 (0.95) SLC6A1TSHRSLC6A11SLC6A13LMNA

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-1158259-C Potassium channel opener ���Ͽع����޹�˾ 2004-07-21 CN disclosed
CN-1282321-A Potassium channel opener ABBOTT LAB (US) 2001-01-31 CN disclosed