SCHEMBL7528093

SCHEMBL7528093

NCCCCOCCCCCCOCCN

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 6/20 0.50
CA12 O43570 2/20 0.50
CA1 P00915 2/20 0.50
CA2 P00918 2/20 0.50
CA3 P07451 2/20 0.50
CA4 P22748 2/20 0.50
CA6 P23280 2/20 0.50
CA5A P35218 2/20 0.50
CA7 P43166 2/20 0.50
CA9 Q16790 2/20 0.50
CA14 Q9ULX7 2/20 0.50
CA5B Q9Y2D0 2/20 0.50
TSHR P16473 2/20 0.50
LMNA P02545 1/20 0.50
BLM P54132 1/20 0.50
NFKB1 P19838 1/20 0.44
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
ALDH1A1 P00352 1/20 0.38
ODC1 P11926 1/20 0.38

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
SCHEMBL4542048 1.00 DNM1 (0.50) DNM1CA12CA1CA2CA3
SCHEMBL24809439 1.00 DNM1 (0.50) DNM1CA12CA1CA2CA3
SCHEMBL7575868 1.00 DNM1 (0.50) DNM1CA12CA1CA2CA3
SCHEMBL23193800 1.00 DNM1 (0.50) DNM1CA12CA1CA2CA3
Hydrochloric Acid SCHEMBL28531431 0.97 DNM1 (0.47) DNM1CA12CA1CA2CA3
SCHEMBL6826021 0.97
SCHEMBL8845613 0.94 NFKB1 (0.44) DNM1CA12CA1CA2CA3
SCHEMBL15259801 0.94 ODC1 (0.45) DNM1CA12CA1CA2CA3
SCHEMBL23226056 0.94 NFKB1 (0.44) DNM1CA12CA1CA2CA3
SCHEMBL3443840 0.94 ODC1 (0.45) DNM1CA12CA1CA2CA3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4543852-A1 PRODUCING SPECIAL ISOCYANATES VIA CO-PHOSGENATION Covestro Deutschland AG (DE) 2025-04-30 EP claimed
CN-119278196-A Production of specific isocyanates by co-phosgenation 科思创德国股份有限公司 2025-01-07 CN claimed
WO-2023247525-A1 PRODUCING SPECIAL ISOCYANATES VIA CO-PHOSGENATION COVESTRO DEUTSCHLAND AG (DE) 2023-12-28 WO claimed
EP-4296260-A1 PREPARATION OF SPECIFIC ISOCYANATES BY CO-PHOSGENATING Covestro Deutschland AG (DE) 2023-12-27 EP claimed
EP-4543852-A1 PRODUCING SPECIAL ISOCYANATES VIA CO-PHOSGENATION Covestro Deutschland AG (DE) 2025-04-30 EP disclosed
CN-119278196-A Production of specific isocyanates by co-phosgenation 科思创德国股份有限公司 2025-01-07 CN disclosed
WO-2023247525-A1 PRODUCING SPECIAL ISOCYANATES VIA CO-PHOSGENATION COVESTRO DEUTSCHLAND AG (DE) 2023-12-28 WO disclosed
EP-4296260-A1 PREPARATION OF SPECIFIC ISOCYANATES BY CO-PHOSGENATING Covestro Deutschland AG (DE) 2023-12-27 EP disclosed
US-20230086342-A1 USE OF SPECIFIC OPEN-CHAIN ETHER ISOCYANATES COVESTRO DEUTSCHLAND AG (DE) 2023-03-23 US disclosed
EP-4118161-A1 USE OF SPECIFIC OPEN-CHAIN ETHER ISOCYANATES Covestro Deutschland AG (DE) 2023-01-18 EP disclosed
CN-115190904-A Use of specific open-chain ether isocyanates 科思创德国股份有限公司 2022-10-14 CN disclosed
EP-3878914-A1 USE OF SPECIFIC OPEN-CHAIN ETHER ISOCYANATES Covestro Deutschland AG (DE) 2021-09-15 EP disclosed
US-20020045723-A1 PROCESS FOR THE PRODUCTION OF ETHER ISOCYANATES BACKGROUND OF THE INVENTION BAYER AKTIENGESELLSCHAFT (DE) 2002-04-18 US disclosed
EP-0764633-B1 Process for the preparation of etherisocyanates BAYER AG (DE) 2001-01-03 EP disclosed
EP-0764633-A2 Process for the preparation of etherisocyanates BAYER AG (DE) 1997-03-26 EP disclosed