SCHEMBL30839741

SCHEMBL30839741

Nc1cccc(-c2ccccc2N)c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.62
HSD17B10 Q99714 1/20 0.62
MAOA P21397 1/20 0.60
MAP4K4 O95819 3/20 0.55
L3MBTL1 Q9Y468 1/20 0.52
KIT P10721 1/20 0.49
CYP3A4 P08684 1/20 0.48
CASP1 P29466 1/20 0.48
RECQL P46063 1/20 0.48
MAPT P10636 3/20 0.46
BRD4 O60885 1/20 0.46
MEN1 O00255 3/20 0.46
KDM4E B2RXH2 2/20 0.46
LMNA P02545 2/20 0.46
HPGD P15428 2/20 0.46
KMT2A Q03164 2/20 0.46
MECP2 P51608 1/20 0.46
PSIP1 O75475 1/20 0.44
AXL P30530 1/20 0.44
MKNK1 Q9BUB5 1/20 0.44

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
SCHEMBL31607638 1.00 ALDH1A1 (0.62) ALDH1A1HSD17B10MAOAMAP4K4L3MBTL1
SCHEMBL29636990 1.00 ALDH1A1 (0.62) ALDH1A1HSD17B10MAOAMAP4K4L3MBTL1
SCHEMBL2442638 1.00 ALDH1A1 (0.62) ALDH1A1HSD17B10MAOAMAP4K4L3MBTL1
Methane SCHEMBL27912757 0.98 ALDH1A1 (0.60) ALDH1A1HSD17B10MAOAMAP4K4L3MBTL1
Ammonia Solution, Strong SCHEMBL21296246 0.98 ALDH1A1 (0.60) ALDH1A1HSD17B10MAOAMAP4K4L3MBTL1
Water SCHEMBL2442366 0.98 ALDH1A1 (0.60) ALDH1A1HSD17B10MAOAMAP4K4L3MBTL1
SCHEMBL18960513 0.96 MAOA (0.61) ALDH1A1HSD17B10MAOAMAP4K4L3MBTL1
Sulfur Dioxide SCHEMBL28983707 0.92 ALDH1A1 (0.54) ALDH1A1HSD17B10MAOAMAP4K4L3MBTL1
SCHEMBL7642833 0.91 MAOA (0.56) ALDH1A1HSD17B10MAOAMAP4K4L3MBTL1
SCHEMBL24254899 0.90 MAOA (0.65) ALDH1A1HSD17B10MAOAMAP4K4L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4594381-A1 NOVEL POLYURETHANE OR POLYURETHANE-UREA COMPOSITION WITH ENHANCED LOW TEMPERATURE PERFORMANCE Ingevity UK Ltd (GB) 2025-08-06 EP claimed
CN-120092033-A Novel polyurethane or polyurethane-urea compositions with enhanced low temperature properties 英格维蒂英国有限公司 2025-06-03 CN claimed
WO-2024068129-A1 NOVEL POLYURETHANE OR POLYURETHANE-UREA COMPOSITION WITH ENHANCED LOW TEMPERATURE PERFORMANCE INGEVITY UK LTD. (GB) 2024-04-04 WO claimed
EP-4594381-A1 NOVEL POLYURETHANE OR POLYURETHANE-UREA COMPOSITION WITH ENHANCED LOW TEMPERATURE PERFORMANCE Ingevity UK Ltd (GB) 2025-08-06 EP disclosed
CN-120092033-A Novel polyurethane or polyurethane-urea compositions with enhanced low temperature properties 英格维蒂英国有限公司 2025-06-03 CN disclosed
WO-2024068129-A1 NOVEL POLYURETHANE OR POLYURETHANE-UREA COMPOSITION WITH ENHANCED LOW TEMPERATURE PERFORMANCE INGEVITY UK LTD. (GB) 2024-04-04 WO disclosed