SCHEMBL10743331

SCHEMBL10743331

C=C(C)n1c(S[Sn](C2CCCCC2)(C2CCCCC2)C2CCCCC2)nc2ccccc2c1=O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ATM Q13315 2/20 0.49
▸ MEN1 O00255 1/20 0.49
▸ KMT2A Q03164 1/20 0.49
▸ ALDH1A1 P00352 6/20 0.47
▸ MAPT P10636 2/20 0.47
▸ LMNA P02545 2/20 0.47
▸ HIF1A Q16665 2/20 0.47
▸ HPGD P15428 1/20 0.47
▸ GAA P10253 2/20 0.44
▸ ALOX15 P16050 1/20 0.44
▸ NPSR1 Q6W5P4 4/20 0.43
▸ PDE7A Q13946 1/20 0.43
▸ PLA2G1B P04054 1/20 0.43
▸ ATG4B Q9Y4P1 1/20 0.43
▸ APOBEC3A P31941 1/20 0.43
▸ APOBEC3G Q9HC16 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ HTT P42858 2/20 0.42
▸ TSHR P16473 1/20 0.42
▸ TDP1 Q9NUW8 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
SCHEMBL10740846 0.80 ATM (0.51) ATMMEN1KMT2AALDH1A1MAPT
SCHEMBL10762337 0.79 TSHR (0.47) MEN1KMT2AALDH1A1PDE7ASMN1; SMN2
SCHEMBL10736120 0.76 TDP1 (0.52) ATMMEN1KMT2AALDH1A1MAPT
SCHEMBL10740921 0.74 TDP1 (0.58) ATMMEN1KMT2AALDH1A1MAPT
SCHEMBL10742659 0.74 TSHR (0.48) ATMALDH1A1MAPTLMNAGAA
SCHEMBL10738200 0.71 PDE7A (0.51) ATMMEN1KMT2AALDH1A1MAPT
SCHEMBL10735496 0.68 ALDH1A1 (0.53) MEN1KMT2AALDH1A1MAPTLMNA
SCHEMBL10739941 0.67 PLA2G1B (0.47) ATMMEN1KMT2AALDH1A1MAPT
SCHEMBL10734167 0.65 KDR (0.51) ALDH1A1MAPTLMNANPSR1PDE7A
SCHEMBL15607039 0.64 NPSR1 (0.75) ATMMEN1KMT2AALDH1A1MAPT

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-4652558-A FUNGICIDES, INSECTICIDES CHEVRON RESEARCH COMPANY (US) 1987-03-24 — — US disclosed
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