SCHEMBL9550827

SCHEMBL9550827

COc1c([N+](=O)[O-])cc(C=O)c(O)c1I

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 14/20 0.52
KDM4E B2RXH2 1/20 0.50
ALDH1A1 P00352 1/20 0.50
CYP3A4 P08684 1/20 0.50
MAPT P10636 1/20 0.50
ALOX15 P16050 1/20 0.50
PRKDC P78527 1/20 0.50
HSD17B10 Q99714 1/20 0.50
TPMT P51580 1/20 0.46

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
SCHEMBL4437002 0.88 ERN1 (0.55) ERN1KDM4EALDH1A1CYP3A4MAPT
SCHEMBL7371372 0.81 KDM4E (0.49) ERN1KDM4EALDH1A1CYP3A4MAPT
SCHEMBL5649150 0.78 KDM4E (0.49) ERN1KDM4EALDH1A1CYP3A4MAPT
SCHEMBL6815825 0.76 GPR35 (0.46) KDM4EALDH1A1MAPTALOX15HSD17B10
SCHEMBL7279701 0.76 KDM4E (0.44) ERN1KDM4EALDH1A1CYP3A4MAPT
SCHEMBL4969724 0.75 ERN1 (0.59) ERN1KDM4EALDH1A1CYP3A4MAPT
SCHEMBL22411776 0.75 ALDH1A1 (0.53) ERN1KDM4EALDH1A1CYP3A4MAPT
SCHEMBL30285913 0.75 ERN1 (0.59) ERN1KDM4EALDH1A1CYP3A4MAPT
SCHEMBL5653572 0.75 ALDH1A1 (0.53) ERN1KDM4EALDH1A1CYP3A4MAPT
SCHEMBL12154699 0.75 ERN1 (0.54) ERN1KDM4EALDH1A1CYP3A4MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250346776-A1 PHOTOHARDENABLE COMPOSITIONS AND METHODS FOR FORMING AN OBJECT IN A VOLUME OF A PHOTOHARDENABLE COMPOSITION QUADRATIC 3D INC (US) 2025-11-13 US disclosed
CN-118076647-A Photohardenable composition and method for forming an object in the volume of the photohardenable composition 二次3D股份有限公司 2024-05-24 CN disclosed
US-20240166912-A1 PHOTOHARDENABLE COMPOSITIONS AND METHODS FOR FORMING AN OBJECT IN A VOLUME OF A PHOTOHARDENABLE COMPOSITION QUADRATIC 3D, INC. 2024-05-23 US disclosed
EP-4352114-A1 PHOTOHARDENABLE COMPOSITIONS AND METHODS FOR FORMING AN OBJECT IN A VOLUME OF A PHOTOHARDENABLE COMPOSITION Quadratic 3D, Inc. (US) 2024-04-17 EP disclosed
WO-2023034398-A1 PHOTOINITIATORS, PHOTOHARDENABLE COMPOSITIONS, AND METHODS FOR FORMING AN OBJECT IN A VOLUME QUADRATIC 3D, INC. (US) 2023-03-09 WO disclosed
WO-2023003819-A1 PHOTOHARDENABLE COMPOSITIONS AND METHODS FOR FORMING AN OBJECT IN A VOLUME OF A PHOTOHARDENABLE COMPOSITION QUADRATIC 3D, INC. (US) 2023-01-26 WO disclosed
US-5230986-A Photohardening compositions with free radical polymerizable compounds STEREOGRAPHICS LIMITED PARTNERSHIP (US) 1993-07-27 US disclosed