SCHEMBL8867488

SCHEMBL8867488

C=COC(=O)Nc1ccc(CCO)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CYP4F2 P78329 4/20 0.44
▸ CYP4A11 Q02928 4/20 0.44
▸ THRA P10827 1/20 0.42
▸ THRB P10828 1/20 0.42
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ NPC1 O15118 1/20 0.39
▸ RECQL P46063 1/20 0.39
▸ RAB9A P51151 1/20 0.39
▸ PYGL P06737 1/20 0.39
▸ HRH3 Q9Y5N1 1/20 0.38
▸ CA2 P00918 1/20 0.37
▸ PPARA Q07869 1/20 0.36
▸ CNR1 P21554 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ HPGD P15428 1/20 0.36
▸ PLAU P00749 1/20 0.36
▸ PIK3CA P42336 1/20 0.36
▸ MTOR P42345 1/20 0.36
▸ PIK3CG P48736 1/20 0.36
▸ HDAC6 Q9UBN7 1/20 0.36

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
SCHEMBL8867476 0.87 THRA (0.42) THRATHRBSMN1; SMN2NPC1RECQL
SCHEMBL8867871 0.81 MEN1 (0.47) CYP4F2CYP4A11THRATHRBSMN1; SMN2
SCHEMBL8000487 0.80 SMN1; SMN2 (0.58) CYP4F2CYP4A11SMN1; SMN2NPC1RAB9A
SCHEMBL8867209 0.78 THRA (0.65) CYP4F2CYP4A11THRATHRB
SCHEMBL12994621 0.76 TGM2 (0.59) SMN1; SMN2NPC1RAB9AALDH1A1
SCHEMBL8767860 0.76 RAD51 (0.44) SMN1; SMN2NPC1RAB9AALDH1A1PLAU
SCHEMBL4153167 0.75 TGM2 (0.57) SMN1; SMN2NPC1RECQLRAB9AALDH1A1
SCHEMBL7123533 0.75 CYP4F2 (0.47) CYP4F2CYP4A11THRATHRBPYGL
SCHEMBL1903659 0.75 CYP4F2 (0.58) CYP4F2CYP4A11SMN1; SMN2NPC1RECQL
SCHEMBL14052828 0.75 HRH3 (0.61) CYP4F2CYP4A11SMN1; SMN2NPC1RAB9A

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-5686484-A ANTHELMINTICS, ACARICIDES, INSECTICIDES SANKYO CO., LTD. (JP) 1997-11-11 — — US disclosed
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