SCHEMBL3236933

SCHEMBL3236933

C=C1C(C)(C)Nc2c(cc(-c3cccc4ncccc34)c3c2CCC3)C1(C)C

nearest known ligand 0.67

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ NR3C1 P04150 10/20 0.67
▸ PGR P06401 2/20 0.46
▸ CA12 O43570 1/20 0.33
▸ CA1 P00915 1/20 0.33
▸ CA2 P00918 1/20 0.33
▸ CA9 Q16790 1/20 0.33
▸ ACVR1 Q04771 4/20 0.33
▸ CYP11B2 P19099 2/20 0.33
▸ CNR2 P34972 1/20 0.33
▸ BPTF Q12830 1/20 0.32
▸ CCNC P24863 1/20 0.31
▸ CDK8 P49336 1/20 0.31

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
SCHEMBL3231133 0.88 NR3C1 (0.86) NR3C1PGRCA12CA1CA2
SCHEMBL3227464 0.87 NR3C1 (0.78) NR3C1PGR
SCHEMBL3233010 0.80 NR3C1 (1.00) NR3C1PGRACVR1
SCHEMBL3227751 0.80 NR3C1 (0.64) NR3C1PGRCA12CA1CA2
SCHEMBL3228882 0.76 NR3C1 (0.78) NR3C1PGR
SCHEMBL3231184 0.75 NR3C1 (0.79) NR3C1PGRACVR1CDK8
SCHEMBL3229026 0.74 NR3C1 (1.00) NR3C1PGR
SCHEMBL3232691 0.73 NR3C1 (0.63) NR3C1PGRACVR1BPTF
SCHEMBL3230488 0.72 NR3C1 (0.80) NR3C1PGR
SCHEMBL3235076 0.72 NR3C1 (0.77) NR3C1PGR

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2116538-B1 CONDENSED TETRAHYDROQUINOLINE DERIVATIVE AND USE THEREOF FOR MEDICAL PURPOSES MITSUBISHI TANABE PHARMA CORP (JP) 2013-03-27 — — EP disclosed
US-8367695-B2 Condensed tetrahydroquinoline derivative and use thereof for medical purposes MITSUBISHI TANABE PHARMA CORPORATION (JP) 2013-02-05 — — US disclosed
US-20100063055-A1 CONDENSED TETRAHYDROQUINOLINE DERIVATIVE AND USE THEREOF FOR MEDICAL PURPOSES MITSUBISHI TANABE PHARMA CORPORATION (JP) 2010-03-11 — — US disclosed
EP-2116538-A1 CONDENSED TETRAHYDROQUINOLINE DERIVATIVE AND USE THEREOF FOR MEDICAL PURPOSES Mitsubishi Tanabe Pharma Corporation (JP) 2009-11-11 — — EP 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-20100063055-A1 CONDENSED TETRAHYDROQUINOLINE DERIVATIVE AND USE THEREOF FOR MEDICAL PURPOSES NR3C2, MC2R, NR5A1 NR3C1 4/4885PGR 11/4885CA12 3489/4885

“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.

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