SCHEMBL11370838

SCHEMBL11370838

CCCC(=O)Nc1cccc(-c2noc(C(C)(C)C)n2)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTPN1 P18031 1/20 0.58
▸ PTPRA P18433 1/20 0.58
▸ KDM4E B2RXH2 4/20 0.54
▸ HSD17B10 Q99714 2/20 0.54
▸ SMN1; SMN2 Q16637 5/20 0.52
▸ TP53 P04637 5/20 0.52
▸ ALDH1A1 P00352 3/20 0.52
▸ GAA P10253 3/20 0.52
▸ POLB P06746 3/20 0.52
▸ HPGD P15428 2/20 0.52
▸ NPC1 O15118 1/20 0.52
▸ RAB9A P51151 1/20 0.52
▸ MAPK1 P28482 1/20 0.52
▸ HTT P42858 1/20 0.52
▸ MAPT P10636 5/20 0.52
▸ F2R P25116 1/20 0.50
▸ GLA P06280 2/20 0.48
▸ HAVCR2 Q8TDQ0 2/20 0.48
▸ USP2 O75604 1/20 0.47
▸ TSHR P16473 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
SCHEMBL11362818 0.82 HDAC6 (0.50) SMN1; SMN2TP53POLBMAPTHAVCR2
SCHEMBL11361867 0.81 MAPK1 (0.52) PTPN1KDM4EHSD17B10SMN1; SMN2TP53
SCHEMBL19994603 0.76 HDAC4 (0.61) TP53
SCHEMBL60207 0.75 NPC1 (0.58) NPC1RAB9A
SCHEMBL10554100 0.74 HDAC4 (0.53) TP53
SCHEMBL12383061 0.74 F2R (0.77) PTPN1PTPRAKDM4EHSD17B10SMN1; SMN2
SCHEMBL10975643 0.73 F2R (0.73) TP53ALDH1A1POLBHPGDRAB9A
SCHEMBL10553916 0.73 TP53 (0.58) TP53POLBMAPT
SCHEMBL10559643 0.73 HDAC4 (0.56) TP53
SCHEMBL19729062 0.73 KCNJ6 (0.59) TP53ALDH1A1HPGDMAPTF2R

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-4243409-A 1,2,4-Oxadiazole derivatives and herbicide composition containing same SCHERING AKTIENGESELLSCHAFT 1981-01-06 — — US claimed
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