SCHEMBL30747873

SCHEMBL30747873

C=C(C)C(=O)Oc1ccccc1NCC

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.47
ELANE P08246 1/20 0.43
TDP1 Q9NUW8 3/20 0.40
THRB P10828 1/20 0.40
GAA P10253 2/20 0.40
ATM Q13315 1/20 0.38
BRD4 O60885 1/20 0.38
KMT2A Q03164 2/20 0.37
KDM4E B2RXH2 2/20 0.37
IDO1 P14902 1/20 0.37
ALDH1A1 P00352 1/20 0.37
POLB P06746 2/20 0.36
CASP6 P55212 1/20 0.36
CYP2C19 P33261 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
PTGS2 P35354 1/20 0.36

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
SCHEMBL146656 1.00 HSD17B10 (0.47) HSD17B10ELANETDP1THRBGAA
SCHEMBL14403113 0.81 HSD17B10 (0.46) HSD17B10TDP1THRBGAAATM
SCHEMBL3251056 0.80 PSIP1 (0.47) HSD17B10ELANEKDM4EALDH1A1PTGS2
SCHEMBL150146 0.79 THRB (0.52) HSD17B10TDP1THRBGAAKMT2A
SCHEMBL27776272 0.79 ALDH1A1 (0.50) HSD17B10ELANEGAABRD4KMT2A
SCHEMBL1232932 0.78 ELANE (0.56) HSD17B10ELANETDP1ATMKMT2A
SCHEMBL30803750 0.78 ELANE (0.56) HSD17B10ELANETDP1ATMKMT2A
SCHEMBL30803748 0.78 ELANE (0.56) HSD17B10ELANETDP1ATMKMT2A
SCHEMBL10878505 0.77 ALDH1A1 (0.40) THRBGAAKMT2AKDM4EALDH1A1
SCHEMBL3256271 0.76 HSD17B10 (0.46) HSD17B10ELANEGAAKMT2AKDM4E

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
EP-4522665-A1 RADIATION INDUCED RADICAL CURING BY SEMICONDUCTING NANOPARTICLES Yeda Research and Development Co. Ltd (IL) 2025-03-19 EP claimed
WO-2023218463-A1 RADIATION INDUCED RADICAL CURING BY SEMICONDUCTING NANOPARTICLES YEDA RESEARCH AND DEVELOPMENT CO. LTD. (IL) 2023-11-16 WO claimed