SCHEMBL31428683

SCHEMBL31428683

CC(=O)N1CCc2ccc(-c3cc(C)nc4ccc(CN(C(=O)OC(C)(C)C)C5CCOCC5)cc34)cc2C1

nearest known ligand 0.34

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.34
MAPK1 P28482 6/20 0.34
NR1H2 P55055 1/20 0.33
IGF1R P08069 1/20 0.33
NR1H4 Q96RI1 1/20 0.33
F10 P00742 3/20 0.32
F2 P00734 1/20 0.32
PLG P00747 1/20 0.32
PRSS1 P07477 1/20 0.32
PRSS2 P07478 1/20 0.32
PRSS3 P35030 1/20 0.32
GRM2 Q14416 1/20 0.32
PIK3CA P42336 1/20 0.32
MTOR P42345 1/20 0.32
CREBBP Q92793 2/20 0.32
CHEK1 O14757 1/20 0.32
KIT P10721 1/20 0.32
FLT3 P36888 1/20 0.32
QRFPR Q96P65 1/20 0.32

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
SCHEMBL24975483 1.00 HSD11B1 (0.34) HSD11B1MAPK1NR1H2IGF1RNR1H4
SCHEMBL24975466 0.97 QRFPR (0.34) HSD11B1MAPK1NR1H4GRM2PIK3CA
SCHEMBL30163591 0.97 QRFPR (0.34) HSD11B1MAPK1NR1H4GRM2PIK3CA
SCHEMBL24975440 0.91 HSD11B1 (0.33) HSD11B1MAPK1NR1H2NR1H4F10
SCHEMBL31428802 0.91 HSD11B1 (0.33) HSD11B1MAPK1NR1H2NR1H4F10
SCHEMBL24975437 0.88 HSD11B1 (0.33) HSD11B1MAPK1NR1H4GRM2PIK3CA
SCHEMBL31429042 0.88 HSD11B1 (0.33) HSD11B1MAPK1NR1H4GRM2PIK3CA
SCHEMBL31428476 0.87 UCHL1 (0.39) HSD11B1CREBBP
SCHEMBL24977267 0.87 UCHL1 (0.39) HSD11B1CREBBP
SCHEMBL31428517 0.83 GRM2 (0.39) HSD11B1NR1H4GRM2

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-20250091994-A1 RAS/RAF BINDING INHIBITOR COMPOUND NATIONAL UNIVERSITY CORPORATION KOBE UNIVERSITY (JP) 2025-03-20 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-20250091994-A1 RAS/RAF BINDING INHIBITOR COMPOUND BRAF, RAF1, NRAS HSD11B1 3183/4885MAPK1 140/4885NR1H2 2120/4885

“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.