SCHEMBL19865595

SCHEMBL19865595

CCCC(O)COc1cccc(OCC(O)CC(C)C)c1

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HIF1A Q16665 1/20 0.55
MAPK1 P28482 2/20 0.51
TSHR P16473 1/20 0.51
KDM4E B2RXH2 2/20 0.48
ADRB2 P07550 2/20 0.46
ADRB1 P08588 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
ACE2 Q9BYF1 1/20 0.44
TP53 P04637 1/20 0.44
LMNA P02545 2/20 0.44
HPGD P15428 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.43
GAA P10253 1/20 0.42
CYP2D6 P10635 1/20 0.41
ADRB3 P13945 1/20 0.41

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
SCHEMBL19865603 0.91 MAPK1 (0.60) HIF1AMAPK1TSHRKDM4EADRB2
SCHEMBL19865604 0.88 MAPK1 (0.54) HIF1AMAPK1TSHRKDM4EADRB2
SCHEMBL4568929 0.84 HIF1A (0.58) HIF1AMAPK1TSHRKDM4EADRB2
SCHEMBL9123406 0.81 ADRB2 (0.62) HIF1AMAPK1TSHRADRB2ADRB1
SCHEMBL2204565 0.81 HIF1A (0.54) HIF1AMAPK1TSHRKDM4EADRB2
SCHEMBL29818706 0.81 HIF1A (0.54) HIF1AMAPK1TSHRKDM4EADRB2
SCHEMBL18653609 0.81 MAPK1 (0.50) HIF1AMAPK1TSHRKDM4EADRB2
SCHEMBL4568899 0.79 HIF1A (0.51) HIF1AMAPK1TSHRKDM4EADRB2
SCHEMBL8437540 0.79 LMNA (0.66) HIF1ATSHRKDM4EADRB2ADRB1
SCHEMBL8437532 0.79 LMNA (0.66) HIF1ATSHRKDM4EADRB2ADRB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10883016-B2 Actinic radiation-curable urethane/urea-containing aerospace coatings and sealants PRC-DESOTO INTERNATIONAL, INC. (US) 2021-01-05 US disclosed
US-20190169465-A1 ACTINIC RADIATION-CURABLE URETHANE/UREA-CONTAINING AEROSPACE COATINGS AND SEALANTS PRC-DESOTO INTERNATIONAL, INC. (US) 2019-06-06 US disclosed
WO-2018031532-A1 ACTINIC RADIATION-CURABLE URETHANE/UREA-CONTAINING AEROSPACE COATINGS AND SEALANTS PRC-DESOTO INTERNATIONAL, INC. (US) 2018-02-15 WO disclosed