SCHEMBL11264274

SCHEMBL11264274

COc1ccc(-c2ccc(C(C)=O)o2)cc1OC

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 3/20 0.69
ABCB1 P08183 3/20 0.56
MAPK1 P28482 6/20 0.55
ALDH1A1 P00352 6/20 0.55
KDM4E B2RXH2 4/20 0.55
HSD17B10 Q99714 3/20 0.55
SMN1; SMN2 Q16637 2/20 0.55
NPC1 O15118 1/20 0.55
RAB9A P51151 1/20 0.55
MAPT P10636 6/20 0.50
LMNA P02545 4/20 0.49
MEN1 O00255 3/20 0.49
KMT2A Q03164 3/20 0.49
CYP3A4 P08684 3/20 0.49
HPGD P15428 2/20 0.49
ABCG2 Q9UNQ0 1/20 0.49
USP2 O75604 1/20 0.48
ELANE P08246 1/20 0.48
RECQL P46063 1/20 0.48
FYN P06241 1/20 0.47

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
SCHEMBL23091223 0.81 PDE4A (0.59) PDE4AABCB1MAPK1ALDH1A1KDM4E
SCHEMBL23091233 0.81 PDE4A (0.59) PDE4AABCB1MAPK1ALDH1A1KDM4E
SCHEMBL11251287 0.79 PDE4A (0.56) PDE4AABCB1MAPK1ALDH1A1KDM4E
SCHEMBL12140121 0.78 ALDH1A1 (0.54) ALDH1A1KDM4EHSD17B10SMN1; SMN2NPC1
SCHEMBL28025699 0.77 ALDH1A1 (0.79) PDE4AABCB1MAPK1ALDH1A1KDM4E
SCHEMBL13078464 0.76 SLC9A1 (0.67) ABCB1MAPK1ALDH1A1KDM4EHSD17B10
SCHEMBL13078670 0.75 RPA1 (0.55) ABCB1ALDH1A1KDM4EHSD17B10NPC1
SCHEMBL11804965 0.75 KDM4E (0.59) MAPK1ALDH1A1KDM4EHSD17B10SMN1; SMN2
SCHEMBL6385751 0.74 PDE4A (0.69) PDE4AABCB1MAPK1ALDH1A1KDM4E
Hydrochloric Acid SCHEMBL11707642 0.74 PDE4A (0.58) PDE4AABCB1MAPK1ALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4332735-A Antifungal compound MORTON-NORWICH PRODUCTS, INC. (US) 1982-06-01 US disclosed