SCHEMBL11045236

SCHEMBL11045236

CCN(CCOCCO)CCOCCO

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.50
MAPK1 P28482 2/20 0.50
ALDH1A1 P00352 2/20 0.48
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
POLB P06746 1/20 0.45
THRB P10828 2/20 0.43
HTT P42858 2/20 0.43
MAPT P10636 1/20 0.43
HSD17B10 Q99714 2/20 0.39
CYP1A2 P05177 2/20 0.39
CYP2C9 P11712 1/20 0.39
HPGD P15428 1/20 0.39
HIF1A Q16665 1/20 0.39
BLM P54132 1/20 0.38
PMP22 Q01453 1/20 0.38
KDM4E B2RXH2 3/20 0.36
CHRM2 P08172 2/20 0.33
CHRM1 P11229 2/20 0.33
DRD3 P35462 1/20 0.33

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
SCHEMBL15965444 0.98 MEN1 (0.52) TSHRMAPK1ALDH1A1MEN1KMT2A
SCHEMBL12970038 0.98 MEN1 (0.52) TSHRMAPK1ALDH1A1MEN1KMT2A
SCHEMBL11387775 0.95 TSHR (0.46) TSHRMAPK1ALDH1A1MEN1KMT2A
SCHEMBL749806 0.95 MEN1 (0.50) TSHRMAPK1ALDH1A1MEN1KMT2A
Ammonia Solution, Strong SCHEMBL4366934 0.93 MEN1 (0.48) TSHRMAPK1ALDH1A1MEN1KMT2A
SCHEMBL7755866 0.93 MEN1 (0.52) TSHRMAPK1ALDH1A1MEN1KMT2A
SCHEMBL18357952 0.93 MEN1 (0.52) TSHRMAPK1ALDH1A1MEN1KMT2A
SCHEMBL7868866 0.88 CYP1A2 (0.47) TSHRMAPK1ALDH1A1MEN1KMT2A
SCHEMBL28810887 0.88 MEN1 (0.48) TSHRMAPK1ALDH1A1MEN1KMT2A
Di(Hydroxyethyl)Ether SCHEMBL9241877 0.87 MAPK1 (0.59) TSHRMAPK1ALDH1A1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3385791-B1 PATTERN FORMATION METHOD, METHOD FOR MANUFACTURING ELECTRONIC DEVICE, LAMINATE FILM, AND UPPER LAYER FILM FORMATION COMPOSITION FUJIFILM CORP (JP) 2024-02-28 EP disclosed
US-20180085766-A1 Foam Dispensing Gun with Third Stream ICP ADHESIVES AND SEALANTS, INC. (US) 2018-03-29 US disclosed
US-9520569-B2 Aryl compounds for application in a highly polar solvent SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-12-13 US disclosed
US-9520569-B2 Aryl compounds for application in a highly polar solvent SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-12-13 US disclosed
US-20140231717-A1 COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2014-08-21 US disclosed
US-20140231717-A1 COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2014-08-21 US disclosed
US-4486324-A WATER-BASE, NONFLAMMABLE EDWIN COOPER, INC. (US) 1984-12-04 US disclosed
US-4247653-A CONDENSATION OF FORMALDEHYDE BAYER AKTIENGESELLSCHAFT (DE) 1981-01-27 US disclosed