SCHEMBL18746575

SCHEMBL18746575

C#CCN(CC#C)C(=O)CCCCC(=O)N(CC#C)CC#C

nearest known ligand 0.60

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.42
ALDH1A1 P00352 2/20 0.38
CYP1A2 P05177 1/20 0.38
CYP2D6 P10635 1/20 0.38
MAPT P10636 1/20 0.38
CYP2C9 P11712 1/20 0.38
CYP2C19 P33261 1/20 0.38
HSD17B10 Q99714 1/20 0.38
TSHR P16473 1/20 0.30

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
SCHEMBL13753302 0.87 CYP1A2 (0.47) LMNAALDH1A1CYP1A2CYP2D6MAPT
SCHEMBL18746574 0.84 ALDH1A1 (0.60) LMNAALDH1A1
SCHEMBL14882711 0.81 PHF8 (0.41) LMNACYP1A2CYP2D6MAPTCYP2C9
SCHEMBL410413 0.79 HMGCR (0.54) LMNAALDH1A1CYP1A2CYP2D6MAPT
Allidochlor SCHEMBL4273793 0.75 NPC1 (0.35) ALDH1A1TSHR
SCHEMBL13913080 0.75 ALDH1A1 (0.33) LMNAALDH1A1
SCHEMBL4621524 0.70 PYCR1 (0.35) LMNAALDH1A1CYP1A2CYP2D6MAPT
SCHEMBL16435062 0.69 ALDH1A1 (0.41) ALDH1A1HSD17B10TSHR
SCHEMBL7200816 0.69 PYCR1 (0.38) ALDH1A1
SCHEMBL7785447 0.69 DPP4 (0.32) ALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3156461-B1 UV CURABLE INKJET INKS AGFA NV (BE) 2020-04-01 EP disclosed
US-10513620-B2 UV curable inkjet inks AGFA NV (BE) 2019-12-24 US disclosed
US-20190071578-A1 UV CURABLE INKJET INKS AGFA NV (BE) 2019-03-07 US disclosed
WO-2017063983-A1 UV CURABLE INKJET INKS AGFA GRAPHICS NV (BE) 2017-04-20 WO disclosed
WO-2017064033-A1 UV CURABLE INKJET INKS AGFA GRAPHICS NV (BE) 2017-04-20 WO disclosed
WO-2017063968-A1 UV CURABLE INKJET INKS AGFA GRAPHICS NV (BE) 2017-04-20 WO disclosed
EP-3156462-A1 UV CURABLE INKJET INKS AGFA GRAPHICS NV (BE) 2017-04-19 EP disclosed
EP-3156463-A1 UV CURABLE INKJET INKS AGFA GRAPHICS NV (BE) 2017-04-19 EP disclosed
EP-3156461-A1 UV CURABLE INKJET INKS AGFA GRAPHICS NV (BE) 2017-04-19 EP disclosed