SCHEMBL18112976

SCHEMBL18112976

CC1(C)OB(c2cc3c(cc2F)OCC(=O)N3)OC1(C)C

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MMP12 P39900 1/20 0.44
NR3C2 P08235 11/20 0.42
PARP1 P09874 2/20 0.42
MAPT P10636 2/20 0.41
TP53 P04637 1/20 0.41
THRB P10828 1/20 0.41
PGR P06401 2/20 0.40
NR3C1 P04150 1/20 0.40
PKM P14618 1/20 0.38
MAPK1 P28482 1/20 0.38
DRD2 P14416 1/20 0.37
DRD4 P21917 1/20 0.37
DRD3 P35462 1/20 0.37
ALDH1A1 P00352 1/20 0.37
KMT2A Q03164 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37

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
SCHEMBL4049030 0.77 MMP12 (0.54) MMP12NR3C2PARP1MAPTTP53
SCHEMBL13035936 0.77 ALDH1A1 (0.41) MAPTALDH1A1
SCHEMBL12060295 0.75 TP53 (0.57) MMP12NR3C2PARP1MAPTTP53
SCHEMBL421621 0.75 CYP11B1 (0.47) MMP12PARP1MAPTPKMDRD2
SCHEMBL30284843 0.75 CYP11B1 (0.47) MMP12PARP1MAPTPKMDRD2
SCHEMBL426743 0.75 MMP12 (0.57) MMP12NR3C2PARP1MAPTPGR
SCHEMBL17092624 0.75 AHR (0.36) PGR
SCHEMBL30905978 0.75 MMP12 (0.57) MMP12NR3C2PARP1MAPTPGR
SCHEMBL16893984 0.75 AR (0.39)
SCHEMBL21382268 0.74 PKM (0.40) PKMKMT2ASMN1; SMN2

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-10710978-B2 STK4 inhibitors for treatment of hematologic malignancies DANA-FARBER CANCER INSTITUTE, INC. (US) 2020-07-14 US disclosed
WO-2016161145-A1 STK4 INHIBITORS FOR TREATMENT OF HEMATOLOGIC MALIGNANCIES DANA-FARBER CANCER INSTITUTE, INC. (US) 2016-10-06 WO 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-10710978-B2 STK4 inhibitors for treatment of hematologic malignancies STK4, STK3, STK11 MMP12 2661/4885NR3C2 804/4885PARP1 989/4885

“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.