SCHEMBL8458992

SCHEMBL8458992

OC(O)C1CCCCCCC1

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TP53 P04637 2/20 0.50
KDM4E B2RXH2 2/20 0.48
GMNN O75496 1/20 0.48
LMNA P02545 1/20 0.48
MAPT P10636 1/20 0.48
BLM P54132 1/20 0.48
PMP22 Q01453 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
EPHX1 P07099 6/20 0.43
SHBG P04278 1/20 0.41
ALDH1A1 P00352 2/20 0.37
HSD17B10 Q99714 1/20 0.37
CYP3A4 P08684 1/20 0.35

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
SCHEMBL40973 1.00
SCHEMBL9493197 1.00 TP53 (0.50) TP53KDM4EGMNNLMNAMAPT
SCHEMBL8392719 1.00 TP53 (0.50) TP53KDM4EGMNNLMNAMAPT
SCHEMBL9815690 1.00 TP53 (0.50) TP53KDM4EGMNNLMNAMAPT
SCHEMBL761168 0.96
SCHEMBL28634026 0.90 TP53 (0.42) TP53KDM4EGMNNLMNAMAPT
SCHEMBL260160 0.89
SCHEMBL8910860 0.81 TP53 (0.30) TP53SHBG
SCHEMBL3182655 0.81
SCHEMBL10982259 0.80 TP53 (0.41) TP53KDM4EGMNNLMNAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102481242-A Use of 1, 3-diols as biocides BASF SE 2012-05-30 CN claimed
CN-102481242-A Use of 1, 3-diols as biocides BASF SE 2012-05-30 CN disclosed
EP-0394781-B1 Thermoplastic moulding compositions based on aromatic polycarbonates and vinylpolymers with higher thermal stability BAYER AG (DE) 1999-01-13 EP disclosed
EP-0411418-B1 Stabilizer dispersions BAYER AG (DE) 1995-02-15 EP disclosed
EP-0402748-B1 Moulding compositions with improved fogging containing vinyl chloride polymers BAYER AG (DE) 1994-08-24 EP disclosed
EP-0394779-B1 Emulsifying agents and process for the preparation of homodisperse polymerdispersions in humps utilizing these emulsifying agents BAYER AG (DE) 1994-06-22 EP disclosed
US-5248727-A Thermoplastic molding material blends with emulsifiers BAYER AKTIENGESELLSCHAFT (DE) 1993-09-28 US disclosed
US-5100945-A Cyclic and bicyclic ester containing carboxylic acids, rubber latices BAYER AKTIENGESELLSCHAFT (DE) 1992-03-31 US disclosed
US-5071946-A Fusing a cycloaliphatic diol with a cycloaliphatic carboxylic anhydride BAYER AKTIENGESELLSCHAFT (DE) 1991-12-10 US disclosed
US-5066717-A Cycloaliphatic Diester Emulsifiers BAYER AKTIENGESELLSCHAFT (DE) 1991-11-19 US disclosed
US-5041485-A Reaction product of diol and carboxylic acid anhydride; storage stability BAYER AKTIENGESELLSCHAFT (DE) 1991-08-20 US disclosed
EP-0411418-A2 Stabilizer dispersions BAYER AG (DE) 1991-02-06 EP disclosed
EP-0402748-A2 Moulding compositions with improved fogging containing vinyl chloride polymers BAYER AG (DE) 1990-12-19 EP disclosed
EP-0394779-A2 Emulsifying agents and process for the preparation of homodisperse polymerdispersions in humps utilizing these emulsifying agents BAYER AG (DE) 1990-10-31 EP disclosed
EP-0394781-A2 Thermoplastic moulding compositions based on aromatic polycarbonates and vinylpolymers with higher thermal stability BAYER AG (DE) 1990-10-31 EP disclosed