SCHEMBL752328

SCHEMBL752328

CCOC(=O)c1cc(Oc2ccc(Cl)c([C@H](C)[C@](O)(c3ccc(=O)n(C)c3)C(F)(F)F)c2)ccc1Cl

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BAZ2B Q9UIF8 1/20 0.43
BAZ2A Q9UIF9 1/20 0.43
CYP4F2 P78329 1/20 0.36
CYP4A11 Q02928 1/20 0.36
MRGPRX4 Q96LA9 1/20 0.34
MAP2K2 P36507 1/20 0.33
MAP2K1 Q02750 1/20 0.33
MLYCD O95822 1/20 0.33
MAPT P10636 2/20 0.33
CYP1A2 P05177 1/20 0.33
KMT2A Q03164 1/20 0.32
P2RX3 P56373 1/20 0.32
NR3C2 P08235 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
BRD4 O60885 1/20 0.32
MAPK1 P28482 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
POLB P06746 1/20 0.32
LMNA P02545 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
SCHEMBL480366 1.00 BAZ2B (0.43) BAZ2BBAZ2ACYP4F2CYP4A11MRGPRX4
SCHEMBL480108 0.94 BAZ2B (0.41) BAZ2BBAZ2AMRGPRX4MAP2K2MAP2K1
SCHEMBL754922 0.94 BAZ2B (0.41) BAZ2BBAZ2AMRGPRX4MAP2K2MAP2K1
SCHEMBL733020 0.89 MEN1 (0.34) BAZ2BBAZ2AMRGPRX4MAPTKMT2A
SCHEMBL752343 0.89 MEN1 (0.34) BAZ2BBAZ2AMRGPRX4MAPTKMT2A
SCHEMBL753316 0.85 MRGPRX4 (0.34) MRGPRX4KMT2AP2RX3BRD4
SCHEMBL480150 0.85 SCN8A (0.34) BAZ2BBAZ2AMRGPRX4CYP1A2KMT2A
SCHEMBL754470 0.85 SCN8A (0.34) BAZ2BBAZ2AMRGPRX4CYP1A2KMT2A
SCHEMBL734137 0.85 MRGPRX4 (0.34) MRGPRX4KMT2AP2RX3BRD4
SCHEMBL480085 0.85 S1PR2 (0.34) BAZ2BBAZ2AKMT2ABRD4

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-8138189-B2 Substituted benzene compounds as modulators of the glucocorticoid receptor HOFFMAN-LA ROCHE INC. (US) 2012-03-20 US disclosed
US-8138189-B2 Substituted benzene compounds as modulators of the glucocorticoid receptor HOFFMAN-LA ROCHE INC. (US) 2012-03-20 US disclosed
US-20100249139-A1 1,1,1-TRIFLUORO-2-HYDROXYPROPYL COMPOUNDS HOFFMANN-LA ROCHE, INC. 2010-09-30 US disclosed
US-20100249139-A1 1,1,1-TRIFLUORO-2-HYDROXYPROPYL COMPOUNDS HOFFMANN-LA ROCHE, INC. 2010-09-30 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-20100249139-A1 1,1,1-TRIFLUORO-2-HYDROXYPROPYL COMPOUNDS NR3C1, NR3C2, CRHR1 BAZ2B 4537/4885BAZ2A 4457/4885CYP4F2 238/4885

“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.