SCHEMBL16792316

SCHEMBL16792316

c1ccc(NC2=NN(c3ccccc3)CN2c2ccccc2)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HSD17B10 Q99714 2/20 0.37
▸ ALB P02768 2/20 0.36
▸ MAPK1 P28482 3/20 0.35
▸ L3MBTL1 Q9Y468 3/20 0.35
▸ TDP1 Q9NUW8 3/20 0.35
▸ ALDH1A1 P00352 2/20 0.35
▸ ALOX12 P18054 2/20 0.35
▸ ALOX15 P16050 1/20 0.35
▸ TSHR P16473 1/20 0.35
▸ PTGS1 P23219 1/20 0.35
▸ SLC6A2 P23975 1/20 0.35
▸ PTGS2 P35354 1/20 0.35
▸ HTR2B P41595 1/20 0.35
▸ CYP1A2 P05177 3/20 0.35
▸ CYP2C9 P11712 3/20 0.35
▸ CYP3A4 P08684 2/20 0.35
▸ CYP2C19 P33261 2/20 0.35
▸ CYP2D6 P10635 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35
▸ MAPT P10636 3/20 0.35

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
Water SCHEMBL9336701 0.98 HSD17B10 (0.35) HSD17B10ALBMAPK1L3MBTL1TDP1
SCHEMBL852946 0.71 NPC1 (0.47) ALBMAPK1L3MBTL1TDP1MAPT
Water SCHEMBL9333649 0.69 LMNA (0.38) HSD17B10ALBL3MBTL1ALDH1A1TSHR
Iodide SCHEMBL11899495 0.69 NPC1 (0.46) ALBMAPK1L3MBTL1TDP1MAPT
SCHEMBL10369622 0.67 KMT2A (0.52) HSD17B10MAPK1L3MBTL1TDP1ALDH1A1
SCHEMBL12220132 0.67 ALB (0.40) ALBMAPK1L3MBTL1TDP1ALDH1A1
SCHEMBL11026530 0.64 HSP90AA1 (0.38) HSD17B10MAPK1L3MBTL1TDP1ALDH1A1
SCHEMBL10417579 0.64 MEN1 (0.50) HSD17B10MAPK1L3MBTL1TDP1ALDH1A1
Diphenylamine SCHEMBL1619083 0.59 HSD17B10 (1.00) HSD17B10MAPK1L3MBTL1TDP1ALDH1A1
Diphenylamine SCHEMBL229 0.59 HSD17B10 (1.00) HSD17B10MAPK1L3MBTL1TDP1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3080178-B1 FORMALDEHYDE-FREE RESINS BASED ON HYDROXYL ALDEHYDES FRAUNHOFER GES FORSCHUNG (DE) 2018-11-21 — — EP disclosed
EP-3080202-A1 WOOD MATERIAL PRODUCT OR NATURAL-FIBER COMPOSITE MATERIAL PRODUCT AND USE OF A FORMALDEHYDE-FREE AMINO OR AMIDE RESIN TO PRODUCE SAID PRODUCT Fraunhofer-Gesellschaft zur Förderung der angewandten Forschung e.V. (DE) 2016-10-19 — — EP disclosed
EP-3080178-A1 FORMALDEHYDE-FREE RESINS BASED ON HYDROXYL ALDEHYDES Fraunhofer-Gesellschaft zur Förderung der angewandten Forschung e.V. (DE) 2016-10-19 — — EP disclosed
WO-2015086035-A1 WOOD MATERIAL PRODUCT OR NATURAL-FIBER COMPOSITE MATERIAL PRODUCT AND USE OF A FORMALDEHYDE-FREE AMINO OR AMIDE RESIN TO PRODUCE SAID PRODUCT Fraunhofer-Gesellschaft zur Förderung der angewandten Forschung e.V. (DE) 2015-06-18 — — WO disclosed
WO-2015086074-A1 FORMALDEHYDE-FREE RESINS BASED ON HYDROXYL ALDEHYDES Fraunhofer-Gesellschaft zur Förderung der angewandten Forschung e.V. (DE) 2015-06-18 — — WO disclosed
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