SCHEMBL1723920

SCHEMBL1723920

CC(C)(CC(=O)C(F)(F)F)c1cccc(F)c1C1OCCCO1

nearest known ligand 0.32

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
RBP4 P02753 1/20 0.32
GAA P10253 2/20 0.31
KMT2A Q03164 2/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2C9 P11712 1/20 0.31
HPGD P15428 1/20 0.31
CYP2C19 P33261 1/20 0.31
POLB P06746 1/20 0.30
MEN1 O00255 1/20 0.30
LDHA P00338 1/20 0.30
TAS1R3 Q7RTX0 1/20 0.30
TAS1R1 Q7RTX1 1/20 0.30
TAS1R2 Q8TE23 1/20 0.30
SSTR4 P31391 1/20 0.30
GRIN2B Q13224 1/20 0.30
FABP4 P15090 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
SCHEMBL1493785 0.81 ALDH1A1 (0.36) RBP4GAAKMT2AHPGDPOLB
SCHEMBL1494001 0.79 OPRL1 (0.36) RBP4GAACYP1A2CYP2C9HPGD
SCHEMBL1723617 0.76 KDM4E (0.33) RBP4GAACYP1A2CYP2C9HPGD
SCHEMBL4483633 0.75 ALDH1A1 (0.42) GAAKMT2AHPGDMEN1
SCHEMBL1493811 0.74 MAPT (0.31) KMT2AHPGDPOLBMEN1
SCHEMBL4423534 0.73 HTR2C (0.36)
SCHEMBL1492619 0.70 KCNN4 (0.35)
SCHEMBL27748407 0.70 NR3C1 (0.63)
SCHEMBL1492582 0.69 ADRA2C (0.33) CYP2C19
SCHEMBL4490225 0.69 MAOB (0.39) GAAHPGDPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8268859-B2 Glucocorticoid mimetics, methods of making them, pharmaceutical compositions and uses thereof BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-09-18 US disclosed
EP-2300472-B1 GLUCOCORTICOID MIMETICS, METHODS OF MAKING THEM, PHARMACEUTICAL COMPOSITIONS, AND USES THEREOF BOEHRINGER INGELHEIM INT (DE) 2012-01-18 EP disclosed
US-20090325988-A1 Glucocorticoid Mimetics, Methods of Making Them, Pharmaceutical Compositions and Uses Thereof BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 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 (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-20090325988-A1 Glucocorticoid Mimetics, Methods of Making Them, Pharmaceutical Compositions and Uses Thereof NR3C1, NR3C2, MC2R RBP4 1344/4885GAA 2611/4885KMT2A 4127/4885

“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.