SCHEMBL3109033

SCHEMBL3109033

Cc1[nH]n(-c2ccc(NS(=O)(=O)c3cccc(Cl)c3)cn2)c(=O)c1Cc1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PGR P06401 8/20 0.53
KDM4E B2RXH2 2/20 0.52
ALKBH3 Q96Q83 6/20 0.47
MT-CO1 P00395 1/20 0.44
MT-CO2 P00403 1/20 0.44
PKM P14618 1/20 0.43
KIT P10721 1/20 0.43
PKLR P30613 1/20 0.41
LMNA P02545 1/20 0.40
MAPT P10636 1/20 0.40
TDP1 Q9NUW8 1/20 0.40

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
SCHEMBL3121393 0.89 KDM4E (0.49) PGRKDM4EALKBH3PKMLMNA
SCHEMBL3119496 0.86 AR (0.50) PGRKDM4ELMNAMAPTTDP1
SCHEMBL3112565 0.85 KDM4E (0.55) KDM4EALKBH3LMNAMAPTTDP1
SCHEMBL3113813 0.83 KDM4E (0.53) KDM4EALKBH3MT-CO1MT-CO2LMNA
SCHEMBL3125409 0.83 KDM4E (0.53) KDM4EALKBH3MT-CO1MT-CO2KIT
SCHEMBL3113740 0.81 KDM4E (0.53) PGRKDM4EALKBH3MAPTTDP1
SCHEMBL13248882 0.78 PGR (0.52) PGRPKMKITLMNAMAPT
SCHEMBL15258736 0.77 KDM4E (0.53) KDM4EALKBH3PKMLMNAMAPT
SCHEMBL2567565 0.73 KDM4E (0.55) KDM4EALKBH3MT-CO1MT-CO2MAPT
SCHEMBL15258818 0.72 KDM4E (0.70) KDM4EALKBH3MT-CO1MT-CO2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100179161-A1 PYRAZOLINE DERIVATIVES FOR THE TREATMENT OF TURBERCULOSIS ASTRAZENECA AB (SE) 2010-07-15 US disclosed
US-20100179161-A1 PYRAZOLINE DERIVATIVES FOR THE TREATMENT OF TURBERCULOSIS ASTRAZENECA AB (SE) 2010-07-15 US disclosed
US-20100179161-A1 PYRAZOLINE DERIVATIVES FOR THE TREATMENT OF TURBERCULOSIS ASTRAZENECA AB (SE) 2010-07-15 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-20100179161-A1 PYRAZOLINE DERIVATIVES FOR THE TREATMENT OF TURBERCULOSIS TREH, TYMP, EPX PGR 3063/4885KDM4E 4245/4885ALKBH3 2762/4885

“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.