SCHEMBL16756283

SCHEMBL16756283

FC(F)Oc1ccccc1Cn1cnc2ccccc21

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 6/20 0.57
CYP11B2 P19099 6/20 0.57
TNF P01375 2/20 0.51
SMN1; SMN2 Q16637 7/20 0.50
MAPT P10636 3/20 0.50
GAA P10253 2/20 0.50
TDP1 Q9NUW8 1/20 0.49
HTT P42858 4/20 0.48
MAPK1 P28482 2/20 0.48
LMNA P02545 6/20 0.47
STAT3 P40763 1/20 0.47
RAB9A P51151 2/20 0.46
BRD4 O60885 1/20 0.45
NPC1 O15118 1/20 0.45
NFKB1 P19838 1/20 0.45
NFKB2 Q00653 1/20 0.45
RELA Q04206 1/20 0.45
PKM P14618 1/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45

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
SCHEMBL4142913 0.80 CYP11B1 (0.77) CYP11B1CYP11B2TNFSMN1; SMN2TDP1
SCHEMBL30826274 0.80 CYP11B1 (0.77) CYP11B1CYP11B2TNFSMN1; SMN2TDP1
Bromide SCHEMBL31253900 0.78 CYP11B1 (0.75) CYP11B1CYP11B2TNFSMN1; SMN2TDP1
Hydrochloric Acid SCHEMBL31253891 0.78 CYP11B1 (0.75) CYP11B1CYP11B2TNFSMN1; SMN2TDP1
SCHEMBL8670922 0.78 SMN1; SMN2 (0.64) CYP11B1CYP11B2TNFSMN1; SMN2MAPT
SCHEMBL30322779 0.76 CYP11B1 (0.67) CYP11B1CYP11B2TNFSMN1; SMN2GAA
SCHEMBL20550865 0.74 CYP11B1 (0.69) CYP11B1CYP11B2TNFSMN1; SMN2TDP1
SCHEMBL28996363 0.73 CYP11B1 (0.67) CYP11B1CYP11B2TNFSMN1; SMN2TDP1
SCHEMBL7215799 0.73 CYP11B1 (0.67) CYP11B1CYP11B2TNFSMN1; SMN2GAA
SCHEMBL16756562 0.73 TDP1 (0.58) CYP11B1CYP11B2TNFSMN1; SMN2GAA

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-9550737-B2 TNF -α modulating benzimidazoles UCB BIOPHARMA SPRL (BE) 2017-01-24 US disclosed
US-20150152065-A1 TNF -Alpha Modulating Benzimidazoles UCB BIOPHARMA SPRL (BE) 2015-06-04 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-20150152065-A1 TNF -Alpha Modulating Benzimidazoles TNF, TNFRSF1A, NFKBIA CYP11B1 2093/4885CYP11B2 2268/4885TNF 1/4885

“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.