SCHEMBL11601293

SCHEMBL11601293

CCC(=O)c1ccc(OC(=S)Cl)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.53
SMN1; SMN2 Q16637 7/20 0.51
RAB9A P51151 5/20 0.51
NPC1 O15118 4/20 0.51
ALDH1A1 P00352 2/20 0.51
MAPT P10636 5/20 0.49
KDM4E B2RXH2 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
ESR1 P03372 1/20 0.47
RECQL P46063 1/20 0.47
HIF1A Q16665 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.46
MEN1 O00255 1/20 0.45
GAA P10253 2/20 0.44
HTT P42858 1/20 0.44
ELANE P08246 1/20 0.44
HPGD P15428 1/20 0.42
ABCB1 P08183 1/20 0.42
HDAC3 O15379 1/20 0.42
HDAC4 P56524 1/20 0.42

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
SCHEMBL11390053 0.79 ELANE (0.58) KMT2ASMN1; SMN2RAB9ANPC1ALDH1A1
SCHEMBL28665285 0.79 KMT2A (0.60) KMT2ASMN1; SMN2RAB9ANPC1ALDH1A1
SCHEMBL26804303 0.78 KMT2A (0.55) KMT2ASMN1; SMN2RAB9ANPC1ALDH1A1
SCHEMBL11052292 0.77 MAPT (0.58) KMT2ASMN1; SMN2RAB9ANPC1ALDH1A1
SCHEMBL26802703 0.76 KMT2A (0.58) KMT2ASMN1; SMN2RAB9ANPC1ALDH1A1
SCHEMBL10499265 0.76 CA12 (0.41) KMT2ASMN1; SMN2RAB9AALDH1A1MAPT
SCHEMBL10690444 0.76 PARP10 (0.57) KMT2AALDH1A1
SCHEMBL8051337 0.76 SMN1; SMN2 (0.70) KMT2ASMN1; SMN2RAB9ANPC1ALDH1A1
SCHEMBL23802411 0.75 KMT2A (0.53) KMT2ASMN1; SMN2RAB9ANPC1ALDH1A1
SCHEMBL20278607 0.75 KMT2A (0.60) KMT2ASMN1; SMN2RAB9ANPC1ALDH1A1

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-4108949-A 6-Hydroxy (alkoxy) phenylthiomethylene di(organophosphorus) compounds and process for making same MONSANTO COMPANY (US) 1978-08-22 US disclosed
US-4071584-A Hydroxyphenylthiophosphoranylidene organophosphorus compounds MONSANTO COMPANY (US) 1978-01-31 US disclosed