SCHEMBL5463124

SCHEMBL5463124

Cc1ccc2c(NCC3(O)c4ccc5c(c4C(C)(C)CC3(O)C(F)(F)F)OCO5)cccc2n1

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 7/20 0.39
PGR P06401 1/20 0.37
USP1 O94782 1/20 0.33
WDR48 Q8TAF3 1/20 0.33
KDM4E B2RXH2 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
MEN1 O00255 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2D6 P10635 1/20 0.32
MAPT P10636 1/20 0.32
MAPK1 P28482 1/20 0.32
CYP2C19 P33261 1/20 0.32
KMT2A Q03164 1/20 0.32
HIF1A Q16665 1/20 0.32
ALDH1A1 P00352 1/20 0.31
GAA P10253 1/20 0.31
TGFBR1 P36897 1/20 0.30

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
SCHEMBL5473783 0.87 NR3C1 (0.42) NR3C1PGR
SCHEMBL5471686 0.82 TRPV1 (0.36)
SCHEMBL5460516 0.81 NR3C1 (0.43) NR3C1PGR
SCHEMBL5462988 0.80 NR3C1 (0.39) NR3C1PGRMEN1KMT2A
SCHEMBL5451945 0.79 NR3C1 (0.35) NR3C1
SCHEMBL5460242 0.79 NR3C1 (0.44) NR3C1PGRUSP1WDR48KDM4E
SCHEMBL5463946 0.78 NR3C1 (0.40) NR3C1PGRMEN1KMT2AGAA
SCHEMBL3532206 0.76 NR3C1 (0.56) NR3C1PGRKDM4ESMN1; SMN2MEN1
SCHEMBL3532207 0.76 NR3C1 (0.56) NR3C1PGRKDM4ESMN1; SMN2MEN1
SCHEMBL5458960 0.71 NR3C1 (0.41) NR3C1PGRUSP1WDR48

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-20070015750-A1 Tetrahydronaphthalene derivatives, process for their production and their use as anti-inflammatory agents BAEURLE STEFAN 2007-01-18 US disclosed
WO-2006108714-A2 TETRAHYDRONAPHTHALENE DERIVATIVES METHOD FOR THE PRODUCTION AND THE USE THEREOF IN THE FORM OF ANTIPHLOGISTICS SCHERING AKTIENGESELLSCHAFT (DE) 2006-10-19 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-20070015750-A1 Tetrahydronaphthalene derivatives, process for their production and their use as anti-inflammatory agents DHPS, TNF, PTGES NR3C1 676/4885PGR 3316/4885USP1 2288/4885

“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.