SCHEMBL28068181

SCHEMBL28068181

CC1CN1S(=O)(=O)c1ccc(N)cc1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.65
TSHR P16473 4/20 0.50
ALDH1A1 P00352 4/20 0.50
MEN1 O00255 3/20 0.50
KMT2A Q03164 3/20 0.50
LMNA P02545 2/20 0.50
MMP2 P08253 2/20 0.50
HTT P42858 1/20 0.50
USP2 O75604 3/20 0.46
PSEN1 P49768 1/20 0.45
PSEN2 P49810 1/20 0.45
APH1B Q8WW43 1/20 0.45
NCSTN Q92542 1/20 0.45
APH1A Q96BI3 1/20 0.45
PSENEN Q9NZ42 1/20 0.45
HTR6 P50406 2/20 0.45
MPO P05164 1/20 0.45
CYP3A4 P08684 1/20 0.45
CYP2C9 P11712 1/20 0.45
CA12 O43570 1/20 0.43

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
SCHEMBL5001507 0.82 L3MBTL1 (0.67) L3MBTL1TSHRALDH1A1LMNAMMP2
SCHEMBL4047383 0.82 L3MBTL1 (0.67) L3MBTL1TSHRALDH1A1LMNAMMP2
SCHEMBL6346703 0.82 L3MBTL1 (0.67) L3MBTL1TSHRALDH1A1LMNAMMP2
SCHEMBL16802354 0.81 PSEN1 (0.66) ALDH1A1KMT2ALMNAUSP2PSEN1
SCHEMBL28453217 0.81 L3MBTL1 (0.65) L3MBTL1MEN1KMT2AMMP2PSEN1
SCHEMBL11149733 0.80 L3MBTL1 (0.96) L3MBTL1TSHRALDH1A1MEN1KMT2A
SCHEMBL23043835 0.80 PSEN1 (0.73) ALDH1A1KMT2ALMNAUSP2PSEN1
SCHEMBL22501644 0.80 PSEN1 (0.73) ALDH1A1KMT2ALMNAUSP2PSEN1
SCHEMBL28576442 0.79 L3MBTL1 (0.62) L3MBTL1ALDH1A1MEN1KMT2ALMNA
Hydrochloric Acid SCHEMBL31379985 0.79 PSEN1 (0.71) ALDH1A1KMT2ALMNAUSP2PSEN1

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
CN-105561729-A Tail gas purifying agent FOSHAN CAS ENV AND SAFETY CERTIFICATION CENTER CO LTD 2016-05-11 CN claimed
CN-105561729-A Tail gas purifying agent FOSHAN CAS ENV AND SAFETY CERTIFICATION CENTER CO LTD 2016-05-11 CN disclosed