SCHEMBL7581969

SCHEMBL7581969

CC(=O)C(CCO)C(C)=O

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.33
GAA P10253 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
ALOX15 P16050 1/20 0.32
THRB P10828 1/20 0.32
GABRP O00591 2/20 0.31
GABRD O14764 2/20 0.31
GABRA1 P14867 2/20 0.31
GABRB1 P18505 2/20 0.31
GABRG2 P18507 2/20 0.31
GABRB3 P28472 2/20 0.31
GABRA5 P31644 2/20 0.31
GABRA3 P34903 2/20 0.31
GABRA2 P47869 2/20 0.31
GABRB2 P47870 2/20 0.31
GABRA4 P48169 2/20 0.31
GABRE P78334 2/20 0.31
GABRA6 Q16445 2/20 0.31
GABRG1 Q8N1C3 2/20 0.31
GABRG3 Q99928 2/20 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
SCHEMBL28221532 0.97 ALDH1A1 (0.32) ALDH1A1GAASMN1; SMN2ALOX15THRB
SCHEMBL65535 0.88 CHRM1 (0.36) ALDH1A1GAASMN1; SMN2GABRPGABRD
SCHEMBL23803658 0.84 LMNA (0.33) ALOX15GABRPGABRDGABRA1GABRB1
SCHEMBL13703468 0.82 CAMK2A (0.33) ALDH1A1SMN1; SMN2TDP1
SCHEMBL10405952 0.80 CHRNB2 (0.31)
SCHEMBL6542747 0.78 GPR84 (0.39) ALDH1A1SMN1; SMN2MEN1MAPTKMT2A
SCHEMBL27821765 0.78 SMN1; SMN2 (0.33) ALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL10565850 0.75 GPR84 (0.37) MAPT
SCHEMBL452330 0.75 TDP1 (0.46) ALDH1A1TDP1
SCHEMBL25787719 0.75 TDP1 (0.38) GAAMEN1KMT2ATDP1

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
CN-113631606-A Compositions and methods for preparing silylated polymers and uses thereof 波利有限公司 2021-11-09 CN disclosed
US-9856149-B2 Vanadium-titanium compound material with high thermal stability and high activity and preparation method thereof NANJING TECH UNIVERSITY (CN) 2018-01-02 US disclosed
CN-106433337-A Preparation method of self-cleaning waterborne fluorocarbon coating 张静 2017-02-22 CN disclosed
US-20150246823-A1 ANADIUM-TITANIUM COMPOUND MATERIAL WITH HIGH THERMAL STABILITY AND HIGH ACTIVITY AND PREPARATION METHOD THEREOF NANJING TECH UNIVERSITY (CN) (CN) 2015-09-03 US disclosed
EP-1189948-A1 METHOD OF SELECTIVELY HYDROGENATING ETHYLENICALLY UNSATURATED DOUBLE BONDS IN POLYMERS BASF AKTIENGESELLSCHAFT (DE) 2002-03-27 EP disclosed
WO-2000073357-A1 METHOD OF SELECTIVELY HYDROGENATING ETHYLENICALLY UNSATURATED DOUBLE BONDS IN POLYMERS BASF AKTIENGESELLSCHAFT (DE) 2000-12-07 WO disclosed
WO-1999044979-A1 AN AQUEOUS METHOD TO PREPARE CYCLOPROPYL METHYLKETONE FROM ACETYL-PROPANOL GREAT LAKES CHEMICAL CORPORATION (US) 1999-09-10 WO disclosed