SCHEMBL3284293

SCHEMBL3284293

Oc1ccc(C2(Cc3ccccc3)CCC(O)(C#CCl)CC2)cc1

nearest known ligand 0.49

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 3/20 0.49
AR P10275 2/20 0.49
ESR2 Q92731 3/20 0.37
GRIN2B Q13224 2/20 0.36
GRIN2D O15399 1/20 0.36
GRIN3B O60391 1/20 0.36
ADRA1D P25100 1/20 0.36
ADRA1A P35348 1/20 0.36
ADRA1B P35368 1/20 0.36
GRIN1 Q05586 1/20 0.36
GRIN2A Q12879 1/20 0.36
GRIN2C Q14957 1/20 0.36
GRIN3A Q8TCU5 1/20 0.36
ADRB2 P07550 2/20 0.35
ALDH1A1 P00352 1/20 0.35
HTT P42858 1/20 0.35
ESR1 P03372 2/20 0.34
OPRL1 P41146 2/20 0.34
CCR3 P51677 1/20 0.33

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
SCHEMBL9618804 0.77 ADRB2 (0.50) ESR2ADRB2ALDH1A1HTTESR1
SCHEMBL12980868 0.71 TSHR (0.52) NR3C1ESR2OPRL1
SCHEMBL22500202 0.69 ESR2 (0.44) NR3C1ARESR2GRIN2BGRIN2D
SCHEMBL7906825 0.69 ESR1 (0.53) ESR2ADRB2ALDH1A1HTTESR1
SCHEMBL12982717 0.69 KDM1A (0.45) NR3C1ALDH1A1OPRL1
SCHEMBL5267941 0.66 DPP4 (0.61) OPRL1
SCHEMBL10606332 0.66 DPP4 (0.55) OPRL1
SCHEMBL12982312 0.65 MAOA (0.44) NR3C1HTTOPRL1
SCHEMBL12981322 0.65 MAOA (0.44) NR3C1ESR2ALDH1A1HTTOPRL1
SCHEMBL49169 0.65 DPP4 (0.59)

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-7713989-B2 Glucocorticoid receptor modulators DOW ROBERT L 2010-05-11 US disclosed
US-20070117805-A1 Glucocorticoid receptor modulators PFIZER INC. 2007-05-24 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-20070117805-A1 Glucocorticoid receptor modulators NR3C1, NR3C2, MC2R NR3C1 1/4885AR 84/4885ESR2 208/4885

“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.