SCHEMBL4938153

SCHEMBL4938153

O=C(C1CCN(c2ccc(=O)[nH]n2)CC1)N1CCN(S(=O)(=O)c2cc3cc(Cl)ccc3[nH]2)CC1

nearest known ligand 0.49

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SMO Q99835 1/20 0.49
F10 P00742 8/20 0.49
CNR1 P21554 2/20 0.48
AKR1B1 P15121 1/20 0.47
USP2 O75604 2/20 0.47
KLK1 P06870 1/20 0.47
ALDH1A1 P00352 1/20 0.47
KMT2A Q03164 2/20 0.44
HTT P42858 3/20 0.42
NPSR1 Q6W5P4 2/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
MAPT P10636 1/20 0.42
ALOX15 P16050 1/20 0.42
TSHR P16473 1/20 0.42
MAPK1 P28482 1/20 0.42
GAA P10253 1/20 0.41

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
SCHEMBL4941913 0.86 F10 (0.50) F10CNR1USP2KLK1ALDH1A1
SCHEMBL4936118 0.85 F10 (0.49) F10CNR1USP2KLK1ALDH1A1
SCHEMBL4935898 0.85 AKR1B1 (0.47) F10CNR1AKR1B1USP2KLK1
SCHEMBL5334159 0.82 F10 (0.47) F10CNR1USP2KLK1ALDH1A1
SCHEMBL4938175 0.82 USP2 (0.49) F10CNR1USP2KLK1ALDH1A1
SCHEMBL4881800 0.76 SMO (0.49) SMOF10CNR1ALDH1A1NPSR1
SCHEMBL4900354 0.76 F10 (0.65) F10AKR1B1KLK1
SCHEMBL4938904 0.74 F10 (0.55) F10KLK1ALDH1A1KMT2A
SCHEMBL4939620 0.74 HRH3 (0.40) F10USP2KLK1HTTSMN1; SMN2
SCHEMBL4942713 0.73 NPSR1 (0.47) F10CNR1USP2KLK1ALDH1A1

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-20080214495-A1 Heterocyclic Sulfonamide Derivatives as Inhibitors of Factor Xa ASTRAZENECA AB (SE) 2008-09-04 US claimed
US-20080214495-A1 Heterocyclic Sulfonamide Derivatives as Inhibitors of Factor Xa ASTRAZENECA AB (SE) 2008-09-04 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-20080214495-A1 Heterocyclic Sulfonamide Derivatives as Inhibitors of Factor Xa F10, F12, F11 SMO 1477/4885F10 1/4885CNR1 23/4885

“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.