SCHEMBL29554866

SCHEMBL29554866

O=[N+]([O-])c1ccc(N=Nc2ccc3ccccc3c2O)c([N+](=O)[O-])c1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 4/20 0.60
▸ TSHR P16473 3/20 0.60
▸ ALOX15 P16050 2/20 0.60
▸ ALOX12 P18054 2/20 0.60
▸ HSD17B10 Q99714 2/20 0.60
▸ CYP1A2 P05177 1/20 0.60
▸ CYP3A4 P08684 1/20 0.60
▸ CYP2D6 P10635 1/20 0.60
▸ CYP2C9 P11712 1/20 0.60
▸ CYP2C19 P33261 1/20 0.60
▸ CSNK2A1 P68400 1/20 0.60
▸ CASP6 P55212 1/20 0.51
▸ TDP1 Q9NUW8 2/20 0.49
▸ KMT2A Q03164 7/20 0.48
▸ MEN1 O00255 6/20 0.48
▸ NPC1 O15118 5/20 0.48
▸ RAB9A P51151 5/20 0.48
▸ L3MBTL1 Q9Y468 3/20 0.48
▸ MAPT P10636 5/20 0.47
▸ ALDH1A1 P00352 4/20 0.47

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
SCHEMBL10766271 0.86 PTPN11 (0.54) HPGDTSHRALOX15ALOX12HSD17B10
SCHEMBL3183992 0.86 PTPN11 (0.54) HPGDTSHRALOX15ALOX12HSD17B10
SCHEMBL305524 0.86 TSHR (0.57) HPGDTSHRALOX15ALOX12HSD17B10
SCHEMBL305525 0.86 TSHR (0.57) HPGDTSHRALOX15ALOX12HSD17B10
SCHEMBL29355385 0.86 TSHR (0.57) HPGDTSHRALOX15ALOX12HSD17B10
SCHEMBL10867802 0.85 KMT2A (0.62) HPGDTSHRALOX15ALOX12HSD17B10
SCHEMBL10867794 0.85 KMT2A (0.62) HPGDTSHRALOX15ALOX12HSD17B10
SCHEMBL29427954 0.85 KMT2A (0.62) HPGDTSHRALOX15ALOX12HSD17B10
SCHEMBL20943080 0.82 S100A4 (0.51) HPGDTSHRALOX15ALOX12HSD17B10
SCHEMBL24187595 0.81 ALDH1A1 (0.55) HPGDTSHRALOX15ALOX12HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024259420-A2 SYSTEMS AND METHODS OF DRY BIOPRINTING WITH BIOPOLYMERS TRUSTEES OF TUFTS COLLEGE (US) 2024-12-19 — — WO disclosed
CN-116879204-A Soil analysis compositions and methods 精密种植有限责任公司 2023-10-13 — — CN disclosed
CN-116879203-A Soil analysis compositions and methods 精密种植有限责任公司 2023-10-13 — — CN disclosed
CN-116879205-A Soil analysis compositions and methods 精密种植有限责任公司 2023-10-13 — — CN disclosed
CN-116840177-A Soil analysis compositions and methods 精密种植有限责任公司 2023-10-03 — — CN disclosed
US-20230302179-A1 MOVING-FRONT STERILIZATION MONITORING DEVICES SOLVENTUM INTELLECTUAL PROPERTIES COMPANY 2023-09-28 — — US disclosed
EP-4196181-A1 MOVING-FRONT STERILIZATION MONITORING DEVICES 3M Innovative Properties Company (US) 2023-06-21 — — EP disclosed
CN-116033930-A Mobile front edge sterilization monitoring device 3M创新有限公司 2023-04-28 — — CN disclosed
US-20230127982-A1 INDICATOR FILM INSIGNIA TECHNOLOGIES LTD (GB) 2023-04-27 — — US disclosed
EP-4121757-A1 INDICATOR FILM Insignia Technologies Limited (GB) 2023-01-25 — — EP disclosed
WO-2022034498-A1 MOVING-FRONT STERILIZATION MONITORING DEVICES 3M INNOVATIVE PROPERTIES COMPANY (US) 2022-02-17 — — WO disclosed
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