SCHEMBL10741060

SCHEMBL10741060

C=CCn1c(S[Sn](C2CCCCC2)(C2CCCCC2)C2CCCCC2)nc2cc(Cl)ccc2c1=O

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 7/20 0.49
▸ SMN1; SMN2 Q16637 5/20 0.49
▸ KDM4E B2RXH2 4/20 0.49
▸ RXFP1 Q9HBX9 1/20 0.48
▸ MEN1 O00255 2/20 0.43
▸ KMT2A Q03164 2/20 0.43
▸ TSHR P16473 2/20 0.43
▸ PLA2G1B P04054 1/20 0.43
▸ HSD17B10 Q99714 1/20 0.43
▸ ATG4B Q9Y4P1 1/20 0.43
▸ LMNA P02545 3/20 0.42
▸ NPSR1 Q6W5P4 2/20 0.41
▸ MAPT P10636 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ HPGD P15428 1/20 0.40
▸ RECQL P46063 1/20 0.40
▸ ALOX15 P16050 1/20 0.38
▸ HTT P42858 1/20 0.38

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
SCHEMBL10739941 0.81 PLA2G1B (0.47) ALDH1A1SMN1; SMN2KDM4ERXFP1MEN1
SCHEMBL10736269 0.78 SMN1; SMN2 (0.55) ALDH1A1SMN1; SMN2KDM4ERXFP1MEN1
SCHEMBL10735118 0.77 ALDH1A1 (0.51) ALDH1A1SMN1; SMN2KDM4EMEN1KMT2A
SCHEMBL877861 0.74 SMN1; SMN2 (0.51) ALDH1A1SMN1; SMN2KDM4EMEN1KMT2A
SCHEMBL10737444 0.70 KMT2A (0.41) ALDH1A1SMN1; SMN2KDM4EMEN1KMT2A
SCHEMBL10736120 0.68 TDP1 (0.52) ALDH1A1SMN1; SMN2KDM4EMEN1KMT2A
SCHEMBL10738200 0.65 PDE7A (0.51) ALDH1A1SMN1; SMN2MEN1KMT2ATSHR
SCHEMBL15093479 0.64 SMN1; SMN2 (0.40) ALDH1A1SMN1; SMN2KDM4ERXFP1MEN1
SCHEMBL6308075 0.63 EGFR (0.49) ALDH1A1SMN1; SMN2KDM4EMEN1KMT2A
SCHEMBL10743331 0.63 ATM (0.49) ALDH1A1SMN1; SMN2RXFP1MEN1KMT2A

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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