SCHEMBL21551833

SCHEMBL21551833

CCC(=O)c1ccc2c(c1)C(CC)(CC)c1cc(Br)ccc1-2

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 6/20 0.38
▸ HPGD P15428 5/20 0.38
▸ ALDH1A1 P00352 4/20 0.38
▸ TSHR P16473 2/20 0.38
▸ ATM Q13315 1/20 0.38
▸ GPR35 Q9HC97 1/20 0.37
▸ SMN1; SMN2 Q16637 2/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ L3MBTL1 Q9Y468 2/20 0.36
▸ USP2 O75604 2/20 0.36
▸ HTT P42858 2/20 0.36
▸ F2 P00734 1/20 0.36
▸ POLB P06746 1/20 0.35
▸ GSK3B P49841 2/20 0.35
▸ HSD17B10 Q99714 1/20 0.35
▸ GAA P10253 1/20 0.35
▸ SRD5A1 P18405 1/20 0.35
▸ SRD5A2 P31213 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
SCHEMBL18012811 0.91 ATM (0.44) MAPTHPGDALDH1A1TSHRATM
SCHEMBL27584898 0.89 MAPT (0.37) MAPTHPGDALDH1A1TSHRATM
SCHEMBL21551956 0.87 MAPT (0.39) MAPTHPGDALDH1A1TSHRATM
SCHEMBL18012808 0.86 MAPT (0.38) MAPTHPGDALDH1A1TSHRATM
SCHEMBL28358222 0.84 HSD17B3 (0.45) MAPTHPGDALDH1A1TSHRATM
SCHEMBL30617326 0.84 PDK2 (0.44) MAPTATMSMN1; SMN2L3MBTL1
SCHEMBL18012749 0.84 PDK2 (0.44) MAPTATMSMN1; SMN2L3MBTL1
SCHEMBL1086094 0.82 PDK2 (0.41) ALDH1A1SMN1; SMN2KMT2AGAA
SCHEMBL29514438 0.82 PDK2 (0.41) ALDH1A1SMN1; SMN2KMT2AGAA
SCHEMBL21560671 0.81 SMN1; SMN2 (0.42) MAPTHPGDALDH1A1TSHRSMN1; SMN2

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
WO-2019216600-A1 NOVEL OXIME ESTER COMPOUND AND PHOTORESIST COMPOSITION COMPRISING SAME 주식회사 트리엘 (KR) 2019-11-14 — — WO disclosed
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