SCHEMBL25167602

SCHEMBL25167602

N=CCNC1CCCCC1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DPP7 Q9UHL4 4/20 0.52
KDM4E B2RXH2 1/20 0.43
ALDH1A1 P00352 2/20 0.39
HSD17B10 Q99714 1/20 0.39
HRH3 Q9Y5N1 1/20 0.38
ADH1B P00325 2/20 0.37
ADH1C P00326 2/20 0.37
ADH1A P07327 2/20 0.37
ADH4 P08319 1/20 0.37
PABPC1 P11940 1/20 0.36
ANPEP P15144 2/20 0.34
ERAP2 Q6P179 2/20 0.34
RAD52 P43351 1/20 0.34
HTT P42858 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
CXCR4 P61073 2/20 0.33
CXCL12 P48061 1/20 0.33
USP2 O75604 1/20 0.33
ADH7 P40394 1/20 0.33
TSHR P16473 1/20 0.33

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
SCHEMBL4551060 0.76 GNAI3 (0.41) DPP7RAD52
SCHEMBL7533868 0.75 DPP7 (0.52) DPP7KDM4EALDH1A1HSD17B10HRH3
SCHEMBL27716571 0.75 DPP7 (0.52) DPP7KDM4EALDH1A1HSD17B10HRH3
SCHEMBL1485739 0.75 DPP7 (0.52) DPP7KDM4EALDH1A1HSD17B10HRH3
SCHEMBL7536595 0.75 DPP7 (0.52) DPP7KDM4EALDH1A1HSD17B10HRH3
SCHEMBL479254 0.75 DPP7 (0.52) DPP7KDM4EALDH1A1HSD17B10HRH3
SCHEMBL14473427 0.75 DPP7 (0.52) DPP7KDM4EALDH1A1HSD17B10HRH3
SCHEMBL8184317 0.75 DPP7 (0.52) DPP7KDM4EALDH1A1HSD17B10HRH3
Hydrochloric Acid SCHEMBL2864272 0.73 DPP7 (0.50) DPP7KDM4EALDH1A1HSD17B10HRH3
Ammonia Solution, Strong SCHEMBL6390287 0.73 DPP7 (0.50) DPP7KDM4EALDH1A1HSD17B10HRH3

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
WO-2023080258-A1 CARBONYL COMPOUND, METHOD FOR PRODUCING CARBONYL COMPOUND, METHOD FOR PRODUCING ISOCYANATE COMPOUND, AND ISOCYANATE COMPOSITION 旭化成株式会社 2023-05-11 WO disclosed
WO-2023080257-A1 METHOD FOR PRODUCING ISOCYANATE COMPOUNDS, METHOD FOR PRODUCING CARBAMATE COMPOUNDS, METHOD FOR RECOVERING AMINE COMPOUNDS, AND ISOCYANATE COMPOSITION 旭化成株式会社 2023-05-11 WO disclosed