SCHEMBL29447706

SCHEMBL29447706

Nc1cc2c(cnn2C(c2ccccc2)(c2ccccc2)c2ccccc2)cc1F

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 1/20 0.35
CYP11B2 P19099 1/20 0.35
NR3C1 P04150 3/20 0.33
MAPT P10636 2/20 0.32
PGR P06401 1/20 0.32
NPC1 O15118 1/20 0.31
HPGD P15428 1/20 0.31
RAB9A P51151 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
IRAK4 Q9NWZ3 1/20 0.31
BCL6 P41182 1/20 0.31

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
SCHEMBL28067981 0.83 MAPT (0.32) MAPT
SCHEMBL29447613 0.83 CYP11B1 (0.35) CYP11B1CYP11B2NR3C1PGR
SCHEMBL20401326 0.78 ACSS2 (0.39) MAPTNPC1HPGDRAB9ASMN1; SMN2
SCHEMBL14895594 0.77 PDPK1 (0.43)
SCHEMBL20401501 0.76 CYP11B1 (0.30) CYP11B1CYP11B2
SCHEMBL29447640 0.74 ABCC9 (0.38) NR3C1PGRNPC1RAB9A
SCHEMBL18113496 0.73 RECQL (0.44) CYP11B1CYP11B2MAPTHPGDRAB9A
SCHEMBL30554368 0.73 RECQL (0.44) CYP11B1CYP11B2MAPTHPGDRAB9A
SCHEMBL20401381 0.72 HTR2A (0.30)
SCHEMBL23901367 0.72 HDAC8 (0.41) CYP11B1CYP11B2NR3C1PGRNPC1

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-11299480-B2 2-arylsulfonamido-N-arylacetamide derivatized STAT3 inhibitors UNIVERSITY OF HAWAII (US) 2022-04-12 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-11299480-B2 2-arylsulfonamido-N-arylacetamide derivatized STAT3 inhibitors STAT3, JAK2, STAT5A CYP11B1 2008/4885CYP11B2 1323/4885NR3C1 978/4885

“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.