SCHEMBL8897364

SCHEMBL8897364

CC(O)Oc1cccc(OC(C)O)c1OC(C)O

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.34
IRAK4 Q9NWZ3 1/20 0.34
ALDH1A1 P00352 2/20 0.33
KDM4E B2RXH2 2/20 0.33
LMNA P02545 1/20 0.33
TP53 P04637 1/20 0.33
CYP3A4 P08684 1/20 0.33
MAPT P10636 1/20 0.33
HPGD P15428 1/20 0.33
ALOX15 P16050 1/20 0.33
ALOX12 P18054 1/20 0.33
MAPK1 P28482 1/20 0.33
HSD17B10 Q99714 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA7 P43166 1/20 0.33
CA9 Q16790 1/20 0.33
ACHE P22303 1/20 0.32
NR2E1 Q9Y466 1/20 0.32
MCHR1 Q99705 1/20 0.32

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
SCHEMBL10661795 0.86 SMN1; SMN2 (0.47) KMT2AALDH1A1KDM4ELMNATP53
SCHEMBL11012886 0.82 KMT2A (0.47) KMT2AIRAK4ALDH1A1KDM4ELMNA
SCHEMBL2962387 0.82 KMT2A (0.47) KMT2AIRAK4ALDH1A1KDM4ELMNA
SCHEMBL15067798 0.81 HTR6 (0.35) KMT2AIRAK4LMNACA1CA2
SCHEMBL15067801 0.81 IRAK4 (0.31) KMT2AIRAK4CA1CA2CA7
SCHEMBL17078209 0.81 CYP1A2 (0.39) KMT2AIRAK4ALDH1A1KDM4ELMNA
SCHEMBL11841236 0.78 HCAR2 (0.43) KMT2AALDH1A1KDM4ELMNAMAPT
SCHEMBL7487004 0.77 HPGD (0.56) ALDH1A1KDM4ELMNATP53CYP3A4
SCHEMBL4744924 0.76 ADRA2A (0.41) KMT2AIRAK4ALDH1A1CA1CA2
SCHEMBL515979 0.76 SCN4A (0.45) KMT2AALDH1A1KDM4ELMNACYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0672720-B1 Formaldehyde-free binding, impregnating or coating composition for fibreous sheets BASF AG (DE) 1997-07-23 EP disclosed
US-5536766-A ACID, ANHYDRIDE ACRYLIC POLYMER; TRIAZINE, BENZENE, CYCLOHEXANE POLYOL CROSSLINKING AGENT BASF AKTIENGESELLSCHAFT (DE) 1996-07-16 US disclosed
EP-0672720-A1 Formaldehyde-free binding, impregnating or coating composition for fibreous sheets BASF AKTIENGESELLSCHAFT (DE) 1995-09-20 EP disclosed
US-4129611-A Thermoplastic polyurethanes of mixtures of hard and soft thermoplast polymers MOBAY CHEMICAL CORPORATION (US) 1978-12-12 US disclosed