SCHEMBL7678186

SCHEMBL7678186

CS(=O)(=O)c1ccc(C(=O)Nc2ccc(CCc3ccc(NC(=O)c4ccc(S(C)(=O)=O)cc4)cc3S(=O)(=O)O)c(S(=O)(=O)O)c2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 1/20 0.57
ADORA2A P29274 1/20 0.57
ADORA2B P29275 1/20 0.57
ADORA1 P30542 1/20 0.57
ENPP2 Q13822 1/20 0.46
CA1 P00915 2/20 0.44
CA2 P00918 2/20 0.44
ROCK2 O75116 1/20 0.44
RORC P51449 1/20 0.44
SIRT2 Q8IXJ6 1/20 0.44
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
NPSR1 Q6W5P4 1/20 0.44
LRRK2 Q5S007 1/20 0.43
ALDH1A1 P00352 3/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
TIMP3 P35625 1/20 0.43
NR1H4 Q96RI1 1/20 0.43
NPC1 O15118 1/20 0.43
TSHR P16473 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
SCHEMBL7665009 0.82 RAD51 (0.59) ADORA3ADORA2AADORA2BADORA1ENPP2
SCHEMBL7665070 0.82 RAD51 (0.59) ADORA3ADORA2AADORA2BADORA1ENPP2
SCHEMBL8023363 0.81 ADORA3 (0.56) ADORA3ADORA2AADORA2BADORA1ENPP2
SCHEMBL8019501 0.81 ADORA3 (0.56) ADORA3ADORA2AADORA2BADORA1ENPP2
SCHEMBL7665092 0.80 LMNA (0.67) CA1CA2MEN1KMT2ANPSR1
SCHEMBL7663761 0.77 RAD51 (0.51) ADORA3ADORA2AADORA2BADORA1ENPP2
SCHEMBL7663771 0.77 RAD51 (0.51) ADORA3ADORA2AADORA2BADORA1ENPP2
SCHEMBL14361824 0.76 ENPP2 (0.57) ENPP2CA1CA2MEN1KMT2A
SCHEMBL7664967 0.76 RAD51 (0.53) ADORA3ADORA2AADORA2BADORA1ENPP2
SCHEMBL7664975 0.76 RAD51 (0.53) ADORA3ADORA2AADORA2BADORA1ENPP2

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
US-20020111369-A1 Aryl sulfonic acids and derivatives as FSH antagonists AMERICAN HOME PRODUCTS CORPORATION (US) 2002-08-15 US claimed
US-20020111369-A1 Aryl sulfonic acids and derivatives as FSH antagonists AMERICAN HOME PRODUCTS CORPORATION (US) 2002-08-15 US 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-20020111369-A1 Aryl sulfonic acids and derivatives as FSH antagonists FSHR, GNRHR, LHCGR ADORA3 1783/4885ADORA2A 3801/4885ADORA2B 3654/4885

“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.