SCHEMBL12236608

SCHEMBL12236608

CC1=CC(C)(C)Nc2ccc(C)c(CCl)c21

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PGR P06401 13/20 0.44
▸ KDM4E B2RXH2 6/20 0.44
▸ MAPT P10636 3/20 0.44
▸ TDP1 Q9NUW8 3/20 0.44
▸ MEN1 O00255 3/20 0.44
▸ KMT2A Q03164 3/20 0.44
▸ L3MBTL1 Q9Y468 2/20 0.44
▸ MAPK1 P28482 1/20 0.44
▸ ALDH1A1 P00352 6/20 0.44
▸ HPGD P15428 5/20 0.44
▸ HSD17B10 Q99714 4/20 0.44
▸ GAA P10253 1/20 0.43
▸ LMNA P02545 2/20 0.42
▸ CYP3A4 P08684 2/20 0.42
▸ AR P10275 1/20 0.40
▸ CYP1A2 P05177 1/20 0.40
▸ CYP2D6 P10635 1/20 0.40
▸ CYP2C9 P11712 1/20 0.40
▸ ALOX15 P16050 1/20 0.40
▸ ALOX12 P18054 1/20 0.40

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
SCHEMBL12236606 0.83 PGR (0.44) PGRKDM4EMAPTTDP1MEN1
SCHEMBL5150689 0.77 NR3C1 (0.56) PGRAR
SCHEMBL2390510 0.76 NR3C1 (0.50) PGRKDM4ETDP1MEN1KMT2A
SCHEMBL12236707 0.74 PGR (0.50) PGRKDM4EMAPTMEN1KMT2A
SCHEMBL5038537 0.74 KDM4E (0.52) PGRKDM4EMAPTMEN1KMT2A
SCHEMBL5034967 0.73 PGR (0.45) PGRKDM4EMAPTMEN1KMT2A
SCHEMBL2393893 0.73 PGR (0.49) PGRAR
SCHEMBL5040853 0.73 PGR (0.47) PGRAR
SCHEMBL5035666 0.72 PGR (0.49) PGRAR
SCHEMBL5032342 0.72 PGR (0.46) PGRKDM4ETDP1MEN1KMT2A

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
US-8420635-B2 Method for preventing or treating a glucocorticoid receptor-related disease SANTEN PHARMACEUTICAL CO., LTD. (JP) 2013-04-16 — — US disclosed
US-20110263589-A1 Method for preventing or treating a glucocorticoid receptor-related disease SANTEN PHARMACEUTICAL CO., LTD. (JP) 2011-10-27 — — US disclosed
US-8017775-B2 1-2-dihydroquinoline derivative having glucocorticoid receptor binding activity SANTEN PHARMACEUTICAL CO., LTD. (JP) 2011-09-13 — — US disclosed
US-20090326009-A1 Novel 1-2-Dihydroquinoline Derivative Having Glucocorticoid Receptor Binding Activity Santen Pharmaceutical Co., (JP) 2009-12-31 — — 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 (2 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-20090326009-A1 Novel 1-2-Dihydroquinoline Derivative Having Glucocorticoid Receptor Binding Activity NR3C1, NR3C2, NR5A1 PGR 201/4885KDM4E 3839/4885MAPT 4652/4885
US-20110263589-A1 Method for preventing or treating a glucocorticoid receptor-related disease NR3C1, NR3C2, NR5A1 PGR 257/4885KDM4E 4659/4885MAPT 3075/4885

“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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