SCHEMBL7798210

SCHEMBL7798210

C=CCCc1cccc(NS(=O)(=O)Cc2ccccc2)n1

nearest known ligand 0.57

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.57
ALDH1A1 P00352 3/20 0.57
HPGD P15428 3/20 0.57
GLO1 Q04760 1/20 0.43
KMT2A Q03164 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
MMP1 P03956 1/20 0.40
MMP2 P08253 1/20 0.40
MMP9 P14780 1/20 0.40
MMP8 P22894 1/20 0.40
MMP13 P45452 1/20 0.40
PGR P06401 1/20 0.39

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
SCHEMBL7798204 0.76 HSD11B1 (0.44) KDM4EALDH1A1HPGD
SCHEMBL9684691 0.67 KDM4E (0.65) KDM4EALDH1A1HPGDGLO1KMT2A
SCHEMBL6924466 0.67 CA1 (0.55) KDM4EALDH1A1HPGDKMT2ACA1
SCHEMBL4064446 0.65 NPSR1 (0.54) KDM4EALDH1A1HPGDKMT2A
Sulfuric Acid SCHEMBL15238309 0.65 MAPT (0.52) KDM4EALDH1A1KMT2ACA1CA2
SCHEMBL1387746 0.65 CA1 (0.57) KDM4EALDH1A1HPGDGLO1KMT2A
SCHEMBL633995 0.64 KMT2A (0.76) KDM4EALDH1A1HPGDKMT2ACA1
SCHEMBL5712482 0.64 SMN1; SMN2 (0.41) KDM4EALDH1A1HPGDKMT2A
SCHEMBL7799450 0.64 NOS2 (0.43)
SCHEMBL11759715 0.64 CA1 (0.45) ALDH1A1KMT2ACA1CA2MMP1

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-20010034445-A1 Vitronectin receptor antagonists SMITHKLINE BEECHAM CORPORATION 2001-10-25 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-20010034445-A1 Vitronectin receptor antagonists ADGRF1, GPR174, CALCRL KDM4E 4737/4885ALDH1A1 2598/4885HPGD 653/4885

“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.