SCHEMBL6281799

SCHEMBL6281799

CC1(C)C(N)=C(c2ccccc2)S(=O)(=O)N1Cc1cccc(Cl)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.45
SIGMAR1 Q99720 2/20 0.43
AMPD2 Q01433 1/20 0.42
MAPT P10636 8/20 0.42
LMNA P02545 2/20 0.42
TP53 P04637 3/20 0.39
ALDH1A1 P00352 2/20 0.39
KDM4E B2RXH2 1/20 0.38
MAPK1 P28482 1/20 0.38
DRD2 P14416 1/20 0.38
POLB P06746 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
NTRK1 P04629 1/20 0.38
SLC16A3 O15427 1/20 0.38
MCTS1 Q9ULC4 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
NPC1 O15118 1/20 0.37
HTT P42858 1/20 0.37
PPARG P37231 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
SCHEMBL6280333 0.90 GAA (0.39) AMPD2ALDH1A1KDM4EPOLBSMN1; SMN2
SCHEMBL6280917 0.81 AMPD2 (0.37) SIGMAR1AMPD2LMNAALDH1A1KDM4E
SCHEMBL28080831 0.64 NR1H2 (0.58) TDP1SIGMAR1MAPTLMNAALDH1A1
SCHEMBL7513351 0.62 MAPT (0.46) TDP1SIGMAR1AMPD2MAPTLMNA
SCHEMBL28550434 0.62 AR (0.56) MAPTLMNAALDH1A1KDM4EMAPK1
SCHEMBL5437022 0.61 MKNK1 (0.62) SIGMAR1LMNAALDH1A1PPARG
SCHEMBL11614006 0.60 KMT2A (0.51) TDP1SIGMAR1MAPTLMNATP53
SCHEMBL3186423 0.60 SMN1; SMN2 (0.56) TDP1SIGMAR1MAPTLMNATP53
SCHEMBL7489542 0.59 GAA (0.38) LMNAALDH1A1KDM4EPOLBSMN1; SMN2
SCHEMBL11811596 0.59 SIGMAR1 (0.50) TDP1SIGMAR1AMPD2MAPTLMNA

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1308316-C Alpha-phenyl-beta-ketosulfone BAYER AG (DE) 2007-04-04 CN disclosed
US-6849744-B2 α-phenyl-β-keto sulfones BAYER AKTIENGESELLSCHAFT (DE) 2005-02-01 US disclosed
US-20040063669-A1 Alpha-phenyl-beta-ketosulfone FISCHER REINER (DE) 2004-04-01 US disclosed
US-6670385-B1 Fungicides, herbicides and insecticides for crops BAYER AKTIENGESELLSCHAFT (DE) 2003-12-30 US disclosed
CN-1364162-A Alpha-phenyl-beta-ketosulfone BAYER AG (DE) 2002-08-14 CN disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040063669-A1 Alpha-phenyl-beta-ketosulfone CYP2S1, SULT1E1, SKP1 TDP1 1808/4885SIGMAR1 471/4885AMPD2 4527/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.