SCHEMBL25311665

SCHEMBL25311665

COC(=O)C(Cl)c1cccc(OCc2ccccc2)c1

nearest known ligand 0.57

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.57
SMN1; SMN2 Q16637 1/20 0.57
MAOB P27338 3/20 0.53
ALOX5 P09917 1/20 0.53
LTA4H P09960 2/20 0.53
NR4A2 P43354 1/20 0.52
SMPD1 P17405 1/20 0.51
EPOR P19235 1/20 0.51
MEN1 O00255 2/20 0.50
BCHE P06276 1/20 0.50
PTGES O14684 1/20 0.49
SGMS2 Q8NHU3 1/20 0.49
PTPN1 P18031 1/20 0.49

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
SCHEMBL31070956 1.00 KMT2A (0.57) KMT2ASMN1; SMN2MAOBALOX5LTA4H
SCHEMBL3485036 0.88 KMT2A (0.56) KMT2ASMN1; SMN2MAOBALOX5NR4A2
SCHEMBL2927329 0.87 KMT2A (0.55) KMT2ASMN1; SMN2MAOBALOX5LTA4H
SCHEMBL9019941 0.85 KMT2A (0.59) KMT2ASMN1; SMN2MAOBALOX5LTA4H
SCHEMBL9432429 0.85 KMT2A (0.59) KMT2ASMN1; SMN2MAOBALOX5LTA4H
SCHEMBL2853880 0.85 ALOX5 (0.63) KMT2ASMN1; SMN2MAOBALOX5LTA4H
SCHEMBL3251101 0.85 LTA4H (0.57) SMN1; SMN2MAOBALOX5LTA4HNR4A2
SCHEMBL3609023 0.84 KMT2A (0.64) KMT2ASMN1; SMN2MAOBALOX5LTA4H
SCHEMBL16767403 0.81 PPARG (0.66) KMT2ASMN1; SMN2MAOBALOX5LTA4H
SCHEMBL30771265 0.81 SGMS2 (0.58) KMT2ASMN1; SMN2MAOBALOX5LTA4H

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
WO-2023137634-A1 TRICYCLIC COMPOUND, PREPARATION THEREFOR, PHARMACEUTICAL COMPOSITION AND USE 上海奕拓医药科技有限责任公司 2023-07-27 WO disclosed
WO-2023137634-A1 TRICYCLIC COMPOUND, PREPARATION THEREFOR, PHARMACEUTICAL COMPOSITION AND USE 上海奕拓医药科技有限责任公司 2023-07-27 WO disclosed