SCHEMBL9171978

SCHEMBL9171978

CCCCC(C)(C=O)CCCC

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.39
SMN1; SMN2 Q16637 1/20 0.37
ADH1B P00325 3/20 0.35
ADH1C P00326 3/20 0.35
ADH1A P07327 3/20 0.35
ADH7 P40394 3/20 0.35
FDPS P14324 1/20 0.34
ADH4 P08319 2/20 0.33
EPHX1 P07099 1/20 0.33
ESR1 P03372 2/20 0.32
ESR2 Q92731 2/20 0.32
FAAH O00519 2/20 0.32
TRPV1 Q8NER1 1/20 0.32
LMNA P02545 1/20 0.32
TRPA1 O75762 1/20 0.31
DDAH1 O94760 1/20 0.31
GAPDH P04406 1/20 0.31
MAPT P10636 1/20 0.31
CA2 P00918 1/20 0.31
MAPK1 P28482 1/20 0.31

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
SCHEMBL9245830 0.95 TSHR (0.39) TSHRSMN1; SMN2ADH1BADH1CADH1A
SCHEMBL5137670 0.95 TSHR (0.36) TSHRSMN1; SMN2ADH1BADH1CADH1A
SCHEMBL9220588 0.90 TSHR (0.44) TSHRADH1BADH1CADH1AADH7
SCHEMBL276807 0.90 TSHR (0.36) TSHRSMN1; SMN2ADH1BADH1CADH1A
SCHEMBL10304506 0.87 TSHR (0.37) TSHRSMN1; SMN2ADH1BADH1CADH1A
SCHEMBL28358059 0.87 TSHR (0.37) TSHRSMN1; SMN2ADH1BADH1CADH1A
SCHEMBL8955012 0.85 FDPS (0.34) TSHRSMN1; SMN2ADH1BADH1CADH1A
SCHEMBL5682325 0.82 ALDH1A1 (0.33) TSHRFDPSLMNAMAPK1ALDH1A1
SCHEMBL5138900 0.82 TSHR (0.37) TSHRSMN1; SMN2ADH1BADH1CADH1A
SCHEMBL6797179 0.80 TSHR (0.41) TSHRADH1BADH1CADH1AADH7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1045177-C Penetrating treatment composition for porous substrates having improved durability and water repellency ROHM & HAAS (US) 1999-09-22 CN disclosed
EP-0290271-B1 Superconducting circuit board and process of manufacturing it FUJITSU LTD (JP) 1995-03-15 EP disclosed
US-5286713-A Method for manufacturing an oxide superconducting circuit board by printing FUJITSU LIMITED (JP) 1994-02-15 US disclosed
EP-0381040-B1 METHOD FOR THE PREPARATION OF 2,2-DIALKYLPROPIONALDEHYDES BASF Aktiengesellschaft (DE) 1993-03-31 EP disclosed
US-5081070-A Alumina board, ceramic FUJITSU LIMITED (JP) 1992-01-14 US disclosed
US-5012006-A Hydroformylation of 1,1-dialkylethylenes in presence of cobalt carbonyl complex catalysts, water-containing solvents or lactones or sulfones BASF AKTIENGESELLSCHAFT (DE) 1991-04-30 US disclosed
EP-0381040-A2 Method for the preparation of 2,2-dialkylpropionaldehydes BASF Aktiengesellschaft (DE) 1990-08-08 EP disclosed
CN-1035313-A Improve porous substrate weather resistance and hydrophobic nature osmotic treated composition ROHM & HAAS (US) 1989-09-06 CN disclosed
EP-0290271-A2 Superconducting circuit board and process of manufacturing it FUJITSU LIMITED (JP) 1988-11-09 EP disclosed