SCHEMBL11686703

SCHEMBL11686703

CCN(c1ccc(S(=O)(=O)O)cc1)S(=O)(=O)c1cc(Cl)c(N)cc1Cl

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ACLY P53396 1/20 0.46
▸ ESR1 P03372 4/20 0.46
▸ LMNA P02545 4/20 0.44
▸ S1PR4 O95977 1/20 0.44
▸ RAB9A P51151 1/20 0.44
▸ ALDH1A1 P00352 4/20 0.41
▸ SMN1; SMN2 Q16637 2/20 0.41
▸ KDM4E B2RXH2 2/20 0.41
▸ MAPT P10636 1/20 0.41
▸ HPGD P15428 1/20 0.41
▸ NSD2 O96028 1/20 0.38
▸ POLB P06746 1/20 0.38
▸ APEX1 P27695 1/20 0.38
▸ RECQL P46063 1/20 0.38
▸ ESR2 Q92731 1/20 0.38
▸ TDP1 Q9NUW8 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ TSHR P16473 2/20 0.37
▸ MAPK1 P28482 2/20 0.37
▸ HCRTR2 O43614 1/20 0.37

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
SCHEMBL11685561 0.83 PSEN1 (0.38) ACLYESR1LMNAS1PR4RAB9A
SCHEMBL11657083 0.83 ALDH1A1 (0.47) LMNARAB9AALDH1A1KDM4EMAPT
Methane SCHEMBL11681369 0.82 ALDH1A1 (0.46) LMNARAB9AALDH1A1KDM4EMAPT
SCHEMBL17774542 0.81 ACLY (0.59) ACLYESR1LMNAS1PR4RAB9A
SCHEMBL11683080 0.79 LMNA (0.41) ACLYESR1LMNAS1PR4RAB9A
Methane SCHEMBL11680886 0.74 ESR1 (0.62) ESR1ALDH1A1TSHRMAPK1KMT2A
SCHEMBL11283353 0.74 ALDH1A1 (0.47) LMNARAB9AALDH1A1SMN1; SMN2HPGD
SCHEMBL5472405 0.74 CNR2 (0.51) ACLYESR1LMNAALDH1A1SMN1; SMN2
SCHEMBL10691315 0.73 ALDH1A1 (0.53) LMNAALDH1A1SMN1; SMN2KDM4EMAPT
SCHEMBL11686420 0.73 ESR1 (0.46) ESR1LMNAS1PR4RAB9AALDH1A1

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-4055557-A MONOAZO DYES BAYER AKTIENGESELLSCHAFT (DT) 1977-10-25 — — US disclosed
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