SCHEMBL126711

SCHEMBL126711

Cc1ccc(N(c2ccc(C(C)C)cc2)c2ccc3ccc4c(N(c5ccc(C(C)C)cc5)c5ccc(C(F)(F)F)cc5)ccc5ccc2c3c54)cc1

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PDE2A O00408 2/20 0.37
TP53 P04637 2/20 0.32
MAPT P10636 2/20 0.32
UTS2R Q9UKP6 2/20 0.31
HRH4 Q9H3N8 1/20 0.31
CRHR1 P34998 1/20 0.31
CNR1 P21554 1/20 0.31
CNR2 P34972 1/20 0.31
PTPN5 P54829 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
SCHEMBL10067191 0.89 CNR2 (0.35) CNR1CNR2
SCHEMBL29444825 0.89 CNR2 (0.35) CNR1CNR2
SCHEMBL126380 0.86 DHFR (0.37)
SCHEMBL12722133 0.84 CNR2 (0.36) MAPTCRHR1CNR1CNR2
SCHEMBL29555023 0.84 CYP2C9 (0.33)
SCHEMBL10066719 0.84 CYP2C9 (0.33)
SCHEMBL124626 0.84 NR1H2 (0.33)
SCHEMBL25569218 0.84 CNR1 (0.31) CNR1CNR2
SCHEMBL19473640 0.83 CNR1 (0.32) CNR1CNR2
SCHEMBL10038732 0.83 PDE2A (0.33) PDE2ATP53MAPTUTS2R

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-20120056165-A1 ORGANIC LUMINESCENT MEDIUM IDEMITSU KOSAN CO., LTD. 2012-03-08 US disclosed
US-20120013244-A1 ORGANIC LUMINESCENT MEDIUM IDEMITSU KOSAN CO., LTD. 2012-01-19 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-20120013244-A1 ORGANIC LUMINESCENT MEDIUM ANXA1, ANXA11, GLB1 PDE2A 2186/4885TP53 350/4885MAPT 2523/4885

“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.