SCHEMBL10552186

SCHEMBL10552186

CCOC(=O)c1cc(F)ccc1COc1cccc(F)c1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MRGPRX4 Q96LA9 2/20 0.50
TDP1 Q9NUW8 2/20 0.50
POLB P06746 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
MAOB P27338 5/20 0.46
TSHR P16473 2/20 0.46
KDM4E B2RXH2 2/20 0.44
LMNA P02545 1/20 0.44
MAOA P21397 1/20 0.44
JAK2 O60674 1/20 0.44
JAK3 P52333 1/20 0.44
NR4A2 P43354 1/20 0.44
MAPK1 P28482 1/20 0.43
HTT P42858 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
HTR6 P50406 1/20 0.43

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
SCHEMBL10557718 0.82 TDP1 (0.51) MRGPRX4TDP1POLBSMN1; SMN2MAOB
SCHEMBL10555079 0.82 NR4A2 (0.56) MRGPRX4MAOBMAOANR4A2
SCHEMBL10562286 0.82 MAOB (0.51) MAOBTSHR
SCHEMBL11933660 0.81 TSHR (0.56) TDP1POLBSMN1; SMN2TSHRKDM4E
SCHEMBL11925272 0.77 TSHR (0.52) TDP1POLBSMN1; SMN2TSHRKDM4E
SCHEMBL1470290 0.77 TSHR (0.52) TDP1POLBSMN1; SMN2TSHRKDM4E
SCHEMBL3982478 0.77 SMN1; SMN2 (0.44) MRGPRX4TDP1POLBSMN1; SMN2MAOB
SCHEMBL14973111 0.77 PAX8 (0.47) MRGPRX4TDP1POLBSMN1; SMN2MAOB
SCHEMBL1957290 0.77 KDM4E (0.49) TDP1POLBSMN1; SMN2TSHRKDM4E
SCHEMBL11455143 0.77 SMN1; SMN2 (0.54) TDP1POLBSMN1; SMN2TSHRKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4889858-A ANTIHYPOXIC AGENTS, ANTICONVULSANTS, LIPID PEROXIDATION INHIBITORS DAINIPPON PHARMACEUTICAL CO., LTD. (JP) 1989-12-26 US disclosed
EP-0269755-A1 DIBENZ b,e OXEPIN DERIVATIVE AND PHARMACEUTICAL CONTAINING THE SAME AS ACTIVE INGREDIENT Dainippon Pharmaceutical Co., Ltd. (JP) 1988-06-08 EP disclosed