SCHEMBL1376468

SCHEMBL1376468

O=C=C1CNc2ccccc21

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NOS2 P35228 1/20 0.37
▸ CA12 O43570 2/20 0.36
▸ CA9 Q16790 2/20 0.36
▸ ALOX15 P16050 1/20 0.36
▸ HSD17B10 Q99714 1/20 0.36
▸ JAK2 O60674 1/20 0.36
▸ BRPF1 P55201 1/20 0.35
▸ GAA P10253 1/20 0.33
▸ NPSR1 Q6W5P4 1/20 0.33
▸ MAOA P21397 1/20 0.33
▸ MAOB P27338 1/20 0.33
▸ PDGFRA P16234 1/20 0.33
▸ FER P16591 1/20 0.33
▸ LTK P29376 1/20 0.33
▸ CDK8 P49336 1/20 0.33
▸ ACVR1 Q04771 1/20 0.33
▸ LRRK2 Q5S007 1/20 0.33
▸ DYRK1B Q9Y463 1/20 0.33
▸ BRD4 O60885 1/20 0.33
▸ CA1 P00915 1/20 0.32

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
SCHEMBL27986266 0.80 BRD4 (0.44) NOS2ALOX15HSD17B10GAAMAOA
SCHEMBL17099674 0.79 NOS2 (0.37) NOS2CA12CA9ALOX15HSD17B10
SCHEMBL68595 0.71 CA12 (0.45) NOS2CA12CA9ALOX15HSD17B10
SCHEMBL30118299 0.70 NOS2 (0.43) NOS2CA12CA9ALOX15HSD17B10
Hydrochloric Acid SCHEMBL2034214 0.70 CA12 (0.43) NOS2CA12CA9ALOX15HSD17B10
Hydrochloric Acid SCHEMBL10863156 0.70 CA12 (0.43) NOS2CA12CA9ALOX15HSD17B10
SCHEMBL17257956 0.68 CA12 (0.42) NOS2CA12CA9ALOX15HSD17B10
Hydrochloric Acid SCHEMBL7397522 0.68 CA12 (0.42) NOS2CA12CA9ALOX15HSD17B10
SCHEMBL9201794 0.68 MAOA (0.48) NOS2CA12CA9ALOX15HSD17B10
SCHEMBL1130729 0.67 NOS2 (0.41) NOS2CA12CA9ALOX15HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-4769461-B2 — — 2011-09-07 — — JP claimed
US-7648738-B2 for photopolymerization; photography, relief imaging; color filters CIBA SPECIALTY CHEMICALS CORPORATION (US) 2010-01-19 — — US claimed
EP-1567518-B1 OXIME ESTER PHOTOINITIATORS WITH HETEROAROMATIC GROUPS CIBA HOLDING INC (CH) 2009-01-14 — — EP claimed
US-20060241259-A1 Oxime ester photoinitiators with heteroaromatic groups CIBA CORPORATION 2006-10-26 — — US claimed
JP-2006516246-A — — 2006-06-29 — — JP claimed
EP-1567518-A2 OXIME ESTER PHOTOINITIATORS WITH HETEROAROMATIC GROUPS Ciba SC Holding AG (CH) 2005-08-31 — — EP claimed
WO-2004050653-A2 OXIME ESTER PHOTOINITIATORS WITH HETEROAROMATIC GROUPS CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2004-06-17 — — WO claimed
CN-113321675-B Chiral 3-methylene indoline compound and preparation method thereof 西华师范大学 2022-07-01 — — CN disclosed
CN-113321675-A Chiral 3-methylene indoline compound and preparation method thereof 西华师范大学 2021-08-31 — — CN disclosed
CN-110128319-A Synthesis method and application of 3-carbonyl indoline fluorescent molecule 南京工业大学 2019-08-16 — — CN disclosed
CN-110128319-A Synthesis method and application of 3-carbonyl indoline fluorescent molecule 南京工业大学 2019-08-16 — — CN disclosed
US-7648738-B2 for photopolymerization; photography, relief imaging; color filters CIBA SPECIALTY CHEMICALS CORPORATION (US) 2010-01-19 — — US disclosed
EP-1567518-B1 OXIME ESTER PHOTOINITIATORS WITH HETEROAROMATIC GROUPS CIBA HOLDING INC (CH) 2009-01-14 — — EP disclosed
US-20060241259-A1 Oxime ester photoinitiators with heteroaromatic groups CIBA CORPORATION 2006-10-26 — — US disclosed
EP-1567518-A2 OXIME ESTER PHOTOINITIATORS WITH HETEROAROMATIC GROUPS Ciba SC Holding AG (CH) 2005-08-31 — — EP disclosed
WO-2004050653-A2 OXIME ESTER PHOTOINITIATORS WITH HETEROAROMATIC GROUPS CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2004-06-17 — — WO disclosed
Send feedback