Sugi Predict

Sugi Predict / Compounds / SCHEMBL20015262

SCHEMBL20015262

SCHEMBL20015262

CCCCC(CC)C(=O)O/N=C(\CCC1CCC(c2ccc3c4cc(C(=O)/C(CCC5CC5)=N/OC(=O)c5ccccc5)ccc4n(CC)c3c2)CC1)C(=O)c1ccc2c(c1)c1ccccc1n2CC

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ PTGER4 P35408 7/20 0.38
▸ CNR2 P34972 4/20 0.35
▸ SCARB1 Q8WTV0 1/20 0.33
▸ ALDH1A1 P00352 2/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ L3MBTL1 Q9Y468 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ LMNA P02545 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ HPGD P15428 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
SCHEMBL20015265 0.91 PTGER4 (0.32) PTGER4
SCHEMBL20015495 0.87 PTGER4 (0.35) PTGER4CNR2SCARB1ALDH1A1MAPT
SCHEMBL17540435 0.86 CNR2 (0.40) PTGER4CNR2KDM4ELMNAMAPT
SCHEMBL20015388 0.84 CNR2 (0.35) PTGER4CNR2L3MBTL1KDM4ELMNA
SCHEMBL17540443 0.84 PTGER4 (0.47) PTGER4CNR2ALDH1A1KMT2AKDM4E
SCHEMBL17540436 0.80 NPC1 (0.45) PTGER4CNR2ALDH1A1KMT2AKDM4E
SCHEMBL29363299 0.77 CNR2 (0.51) PTGER4CNR2ALDH1A1KMT2AKDM4E
SCHEMBL20015506 0.77 PTGER4 (0.30) PTGER4
SCHEMBL20015493 0.76 PTGER4 (0.30) PTGER4
SCHEMBL17540438 0.74 PTGER4 (0.40) PTGER4CNR2ALDH1A1KMT2AKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3002632-B1 ACRYLIC PHOTOCURABLE COMPOSITION CHANGZHOU TRONLY ADVANCED ELECTRONICS MAT CO LTD (CN) 2018-03-28 — — EP disclosed