SCHEMBL8867476

SCHEMBL8867476

C=COC(=O)Nc1ccc(CC[O])cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ THRA P10827 2/20 0.42
▸ THRB P10828 2/20 0.42
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ RAB9A P51151 2/20 0.39
▸ NPC1 O15118 1/20 0.39
▸ RECQL P46063 1/20 0.39
▸ HRH3 Q9Y5N1 1/20 0.38
▸ CNR1 P21554 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ HPGD P15428 1/20 0.36
▸ PLAU P00749 1/20 0.36
▸ POLB P06746 1/20 0.36
▸ TGM2 P21980 2/20 0.35
▸ MAPT P10636 1/20 0.35
▸ HDAC3 O15379 1/20 0.35
▸ HDAC4 P56524 1/20 0.35
▸ HDAC1 Q13547 1/20 0.35
▸ HDAC7 Q8WUI4 1/20 0.35
▸ HDAC2 Q92769 1/20 0.35
▸ HDAC10 Q969S8 1/20 0.35

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
SCHEMBL8867488 0.87 CYP4F2 (0.44) THRATHRBSMN1; SMN2RAB9ANPC1
SCHEMBL8867866 0.81 MEN1 (0.47) THRATHRBSMN1; SMN2RAB9ANPC1
SCHEMBL8867193 0.80 SMN1; SMN2 (0.58) SMN1; SMN2RAB9ANPC1RECQLHRH3
SCHEMBL8867192 0.78 THRA (0.65) THRATHRBTGM2
SCHEMBL8767860 0.76 RAD51 (0.44) SMN1; SMN2RAB9ANPC1ALDH1A1PLAU
SCHEMBL12994621 0.76 TGM2 (0.59) SMN1; SMN2RAB9ANPC1ALDH1A1POLB
SCHEMBL4153167 0.75 TGM2 (0.57) SMN1; SMN2RAB9ANPC1RECQLALDH1A1
SCHEMBL8867661 0.75 RAB9A (0.56) SMN1; SMN2RAB9ANPC1RECQLALDH1A1
SCHEMBL8867545 0.74 NPC1 (0.59) SMN1; SMN2RAB9ANPC1HRH3ALDH1A1
SCHEMBL8868161 0.74 CNR1 (0.50) THRATHRBSMN1; SMN2RAB9ANPC1

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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