SCHEMBL7597225

SCHEMBL7597225

C=CCCCCCCCCC(=O)Oc1ccc(O)c(C=C(N)CCC(N)C=C(C=O)c2ccccc2)c1

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PRSS1 P07477 1/20 0.32
PRSS2 P07478 1/20 0.32
PRSS3 P35030 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
SCHEMBL7598397 0.89 ALDH1A1 (0.33)
SCHEMBL7597221 0.74 CA2 (0.33) PRSS1PRSS2PRSS3
SCHEMBL7596265 0.73 KMT2A (0.48)
SCHEMBL7596822 0.68 CA2 (0.43) PRSS1PRSS2PRSS3
SCHEMBL7596825 0.68 CA2 (0.43) PRSS1PRSS2PRSS3
SCHEMBL28433913 0.67 ESR1 (0.48) PRSS1PRSS2PRSS3
SCHEMBL24565376 0.66 PRSS1 (0.56) PRSS1PRSS2PRSS3
SCHEMBL7587172 0.66 PRSS1 (0.56) PRSS1PRSS2PRSS3
SCHEMBL8003045 0.65 PRSS1 (0.55) PRSS1PRSS2PRSS3
SCHEMBL10952993 0.65 PRSS1 (0.54) PRSS1PRSS2PRSS3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0927155-B1 METAL-CONTAINING SIDE CHAIN LIQUID CRYSTAL POLYMERS QINETIQ LTD (GB) 2002-11-20 EP disclosed
US-6184322-B1 USED IN DISPLAY TECHNOLOGY, THIN FILM MAGNETIC MATERIALS FOR USE IN DATA STORAGE, LUBRICANTS AND ANISOTROPICALLY SUPPORTED CATALYSTS THE SECRETARY OF STATE FOR DEFENCE IN HER BRITANNIC MAJESTY'S GOVERNMENT OF THE UNITED KINGDOM OF GREAT BRITAIN AND NORTHERN IRELAND (GB) 2001-02-06 US disclosed
EP-0927155-A1 METAL-CONTAINING SIDE CHAIN LIQUID CRYSTAL POLYMERS THE SECRETARY OF STATE FOR DEFENCE (GB) 1999-07-07 EP disclosed
WO-1997049671-A1 METAL-CONTAINING SIDE CHAIN LIQUID CRYSTAL POLYMERS THE SECRETARY OF STATE FOR DEFENCE (GB) 1997-12-31 WO disclosed