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SCHEMBL24624045

SCHEMBL24624045

N#CCCP(=O)(CCC#N)CCP(=O)(CCC#N)CCP(=O)(CCC#N)CCP(=O)(CCC#N)CCC#N

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41
▸ TSHR P16473 3/20 0.33
▸ LOX P28300 1/20 0.33
▸ LOXL3 P58215 1/20 0.33
▸ LOXL2 Q9Y4K0 1/20 0.33
▸ CYP3A4 P08684 1/20 0.33
▸ NLRP3 Q96P20 1/20 0.32

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
SCHEMBL24624356 1.00 ALDH1A1 (0.41) ALDH1A1TDP1TSHRLOXLOXL3
SCHEMBL11355044 1.00 ALDH1A1 (0.41) ALDH1A1TDP1TSHRLOXLOXL3
SCHEMBL517724 0.97 ALDH1A1 (0.44) ALDH1A1TDP1TSHRLOXLOXL3
SCHEMBL24624046 0.92 ALDH1A1 (0.35) ALDH1A1TDP1TSHRCYP3A4
SCHEMBL24624360 0.88 ALDH1A1 (0.37) ALDH1A1TDP1TSHRLOXLOXL3
SCHEMBL24624359 0.88 ALDH1A1 (0.37) ALDH1A1TDP1TSHRLOXLOXL3
SCHEMBL25837819 0.87 TSHR (0.40) ALDH1A1TDP1TSHRNLRP3
SCHEMBL24624077 0.86 TSHR (0.38) ALDH1A1TDP1TSHR
SCHEMBL24624076 0.86 TSHR (0.38) ALDH1A1TDP1TSHR
SCHEMBL24624067 0.85 ALDH1A1 (0.30) ALDH1A1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220223914-A1 ELECTROLYTE, ELECTROCHEMICAL DEVICE, AND ELECTRONIC DEVICE NINGDE AMPEREX TECHNOLOGY LIMITED (CN) 2022-07-14 — — US disclosed