SCHEMBL3417199

SCHEMBL3417199

CC(C)(C)Oc1ccc(C2(C)CC(C)(C)c3ccc(O)cc32)cc1

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 1/20 0.35
SLC6A4 P31645 1/20 0.35
SLC6A3 Q01959 1/20 0.35
KDM4E B2RXH2 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
ATM Q13315 1/20 0.32
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32
CYP3A4 P08684 1/20 0.32
PDE2A O00408 1/20 0.31
RXRA P19793 1/20 0.30
RXRB P28702 1/20 0.30
RXRG P48443 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
SCHEMBL3418438 0.92 SLC6A2 (0.33) SLC6A2SLC6A4SLC6A3KDM4EMEN1
SCHEMBL3412367 0.85 ATM (0.45) ATMALDH1A1LMNACYP3A4
SCHEMBL7996227 0.84 ALDH1A1 (0.38) ALDH1A1LMNACYP3A4
SCHEMBL7996188 0.84 ALDH1A1 (0.38) ALDH1A1LMNACYP3A4
SCHEMBL29459356 0.84 ALDH1A1 (0.38) ALDH1A1LMNACYP3A4
SCHEMBL728580 0.84 ALDH1A1 (0.38) ALDH1A1LMNACYP3A4
SCHEMBL11405742 0.81 LTA4H (0.45) KDM4EMEN1KMT2AATMALDH1A1
SCHEMBL728078 0.81 ALDH1A1 (0.38) ALDH1A1LMNACYP3A4
SCHEMBL12760926 0.80 NR3C1 (0.39) ALDH1A1LMNACYP3A4
SCHEMBL3421140 0.79 CYP3A4 (0.34) ATMALDH1A1LMNACYP3A4

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-7767739-B2 Cyanato group-containing cyclic phosphazene compound and method for producing the same FUSHIMI PHARMACEUTICAL CO., LTD. (JP) 2010-08-03 US disclosed
US-20090170983-A1 Cyanato Group-Containing Cyclic Phosphazene Compound and Method for Producing The Same FUSHIMI PHARMACEUTICAL CO., LTD. (JP) 2009-07-02 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-20090170983-A1 Cyanato Group-Containing Cyclic Phosphazene Compound and Method for Producing The Same CENPE, CPNE4, MCM3 SLC6A2 4784/4885SLC6A4 4590/4885SLC6A3 4624/4885

“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.