SCHEMBL8577019

SCHEMBL8577019

[CH2]CCCCCCCCCOCCOCCCC

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.54
MEN1 O00255 1/20 0.54
THRB P10828 1/20 0.54
KMT2A Q03164 1/20 0.54
MAPT P10636 1/20 0.54
TSHR P16473 2/20 0.48
CYP3A4 P08684 1/20 0.46
CES2 O00748 2/20 0.40
ALDH1A1 P00352 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
USP2 O75604 1/20 0.38
CA1 P00915 8/20 0.37
CA2 P00918 8/20 0.37
CA9 Q16790 7/20 0.37
CA12 O43570 3/20 0.37
CA7 P43166 3/20 0.37
CA14 Q9ULX7 3/20 0.37
CA3 P07451 2/20 0.37
CA4 P22748 2/20 0.37
CA6 P23280 2/20 0.37

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
SCHEMBL8576723 1.00 HTT (0.54) HTTMEN1THRBKMT2AMAPT
SCHEMBL816285 0.97 TSHR (0.50) HTTMEN1THRBKMT2AMAPT
SCHEMBL130731 0.97 TSHR (0.50) HTTMEN1THRBKMT2AMAPT
SCHEMBL817599 0.97 TSHR (0.50) HTTMEN1THRBKMT2AMAPT
SCHEMBL816140 0.97 TSHR (0.50) HTTMEN1THRBKMT2AMAPT
SCHEMBL816279 0.97 TSHR (0.50) HTTMEN1THRBKMT2AMAPT
SCHEMBL818096 0.97 TSHR (0.50) HTTMEN1THRBKMT2AMAPT
SCHEMBL816419 0.97 TSHR (0.50) HTTMEN1THRBKMT2AMAPT
SCHEMBL820419 0.97 TSHR (0.50) HTTMEN1THRBKMT2AMAPT
SCHEMBL816971 0.97 TSHR (0.50) HTTMEN1THRBKMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5801258-A Amide derivatives and dermatologic preparations containing the same KAO CORPORATION (JP) 1998-09-01 US disclosed
US-5753707-A TREATING SKIN DISORDER, DERMATITIS, ROUGH SKIN; BARRIER FUNCTION KAO CORPORATION (JP) 1998-05-19 US disclosed
EP-0623124-B1 AMIDE DERIVATIVES AND DERMATOLOGIC PREPARATIONS CONTAINING THE SAME KAO CORP (JP) 1998-02-18 EP disclosed
US-5659052-A APPLYING TO SKIN TO IMPROVE BARRIER FUNCTIONS OF HORNY LAYER KAO CORPORATION (JP) 1997-08-19 US disclosed
EP-0761644-A2 Amide derivatives and their use in cosmetic composition KAO CORPORATION (JP) 1997-03-12 EP disclosed
EP-0623124-A1 AMIDE DERIVATIVES AND DERMATOLOGIC PREPARATIONS CONTAINING THE SAME Kao Corporation (JP) 1994-11-09 EP disclosed
WO-1994012490-A2 AMIDE DERIVATIVES AND DERMATOLOGIC PREPARATIONS CONTAINING THE SAME KAO CORPORATION (JP) 1994-06-09 WO disclosed