SCHEMBL9808068

SCHEMBL9808068

O=C(CSc1ccc(O)c(Cl)c1)OCCCSc1ccc(O)c(Cl)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 4/20 0.38
L3MBTL1 Q9Y468 3/20 0.38
ALDH1A1 P00352 3/20 0.38
ALOX15 P16050 1/20 0.38
BCL2L11 O43521 2/20 0.37
BCL2L1 Q07817 2/20 0.37
MCL1 Q07820 2/20 0.37
THRB P10828 1/20 0.37
CYP19A1 P11511 1/20 0.36
CA2 P00918 1/20 0.36
HTT P42858 2/20 0.35
PKM P14618 1/20 0.35
MEN1 O00255 1/20 0.35
RAB9A P51151 1/20 0.35
KMT2A Q03164 1/20 0.35
ATM Q13315 1/20 0.35
GAA P10253 2/20 0.35
MAPT P10636 2/20 0.35
KDM4E B2RXH2 1/20 0.35
CYP1A2 P05177 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
SCHEMBL9808292 0.92 BCL2L11 (0.38) TDP1L3MBTL1ALDH1A1BCL2L11BCL2L1
SCHEMBL9808202 0.87 APP (0.41) TDP1L3MBTL1ALDH1A1HTTPKM
SCHEMBL9808284 0.83 ATM (0.38) TDP1L3MBTL1BCL2L11BCL2L1MCL1
SCHEMBL9808197 0.81 MAPT (0.38) TDP1L3MBTL1CYP19A1CA2HTT
SCHEMBL9808190 0.81 HDAC6 (0.49) TDP1ALDH1A1HTTMEN1RAB9A
SCHEMBL9808205 0.79 HSP90AA1 (0.42) TDP1L3MBTL1ALDH1A1CA2HTT
SCHEMBL9750096 0.78 THRB (0.45) TDP1THRBCYP19A1CA2MEN1
SCHEMBL9808053 0.78 APP (0.43) ALDH1A1BCL2L11BCL2L1MCL1CA2
SCHEMBL9808327 0.78 TSHR (0.41) TDP1L3MBTL1THRBCYP19A1CA2
SCHEMBL9808195 0.77 HTT (0.52) TDP1ALDH1A1CA2HTTPKM

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
US-4985393-A Bis/hydroxyphenylthio/ Compounds KANZAKI PAPER MANUFACTURING CO., LTD. (JP) 1991-01-15 US disclosed
EP-0373561-A2 Heat sensitive recording material KANZAKI PAPER MANUFACTURING CO., LTD. (JP) 1990-06-20 EP disclosed