SCHEMBL3227746

SCHEMBL3227746

Cc1cc(O)ccc1-c1cc2c(c3c1OCO3)NC(C)(C)C(=O)C2(C)C

nearest known ligand 0.58

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ NR3C1 P04150 13/20 0.58
▸ PGR P06401 5/20 0.58
▸ ESR1 P03372 4/20 0.36
▸ ESR2 Q92731 3/20 0.36
▸ CDK2 P24941 1/20 0.34
▸ LMNA P02545 1/20 0.32
▸ POLB P06746 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ ALOX12 P18054 1/20 0.32
▸ NPSR1 Q6W5P4 1/20 0.32
▸ GPR55 Q9Y2T6 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ ALDH1A1 P00352 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
SCHEMBL3232735 0.80 NR3C1 (0.57) NR3C1PGRESR1ESR2LMNA
SCHEMBL13458942 0.73 NR3C1 (0.57) NR3C1PGR
SCHEMBL3234048 0.72 NR3C1 (0.67) NR3C1PGR
SCHEMBL3229068 0.72 NR3C1 (0.40) NR3C1PGRPOLBALDH1A1
SCHEMBL3233100 0.72 NR3C1 (0.58) NR3C1PGR
SCHEMBL13431431 0.71 NR3C1 (0.55) NR3C1PGR
SCHEMBL3232655 0.69 NR3C1 (0.55) NR3C1PGRESR1ESR2POLB
SCHEMBL3235058 0.65 NR3C1 (0.43) NR3C1PGRLMNAMAPTKDM4E
SCHEMBL3226471 0.63 NR3C1 (0.64) NR3C1PGR
SCHEMBL29494601 0.61 ESR2 (0.74) ESR1ESR2MAPTALOX12ALDH1A1

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-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

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 11/4885ESR1 216/4885

“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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