SCHEMBL6652229

SCHEMBL6652229

CCCCCCCCCCCCCCCCCCCC(OC(CCCCCCCCCCCCCCCCCCC)C(CC)CCCCC)C(CC)CCCCC

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.38
DNM1 Q05193 2/20 0.37
TSHR P16473 1/20 0.36
THRB P10828 1/20 0.36
OPRM1 P35372 1/20 0.36
SMPD1 P17405 3/20 0.35
PTPN1 P18031 1/20 0.35
GPR84 Q9NQS5 3/20 0.34
FDPS P14324 3/20 0.34
SPHK1 Q9NYA1 1/20 0.34
FFAR1 O14842 1/20 0.34

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
SCHEMBL7997300 0.98 DNM1 (0.41) LMNADNM1TSHRTHRBOPRM1
SCHEMBL14958034 0.93 ZDHHC7 (0.37) LMNADNM1TSHRTHRBOPRM1
SCHEMBL14802122 0.93 LMNA (0.39) LMNADNM1TSHRTHRBOPRM1
SCHEMBL5820966 0.91 LMNA (0.41) LMNADNM1TSHRTHRBOPRM1
SCHEMBL2771768 0.91 LMNA (0.41) LMNADNM1TSHRTHRBOPRM1
SCHEMBL7536622 0.91 ALDH1A1 (0.36) LMNADNM1TSHRFDPS
SCHEMBL10595438 0.84 ALDH1A1 (0.34) LMNADNM1TSHR
SCHEMBL5821128 0.84 LMNA (0.39) LMNADNM1TSHRTHRBOPRM1
SCHEMBL11801907 0.83 LMNA (0.50) LMNATSHRSMPD1PTPN1GPR84
SCHEMBL28663452 0.81 ALDH1A1 (0.36) LMNADNM1TSHRFDPS

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
EP-1133596-B1 WATERPROOFING AGENTS FOR TEXTILE FINISHING COGNIS DEUTSCHLAND GMBH (DE) 2004-03-17 EP disclosed
EP-1133596-A1 WATERPROOFING AGENTS FOR TEXTILE FINISHING Cognis Deutschland GmbH (DE) 2001-09-19 EP disclosed
WO-2000032866-A1 WATERPROOFING AGENTS FOR TEXTILE FINISHING COGNIS DEUTSCHLAND GMBH (DE) 2000-06-08 WO disclosed