SCHEMBL23743365

SCHEMBL23743365

CC1(C)c2cccc(-c3nc(-c4cccc(-c5ccccc5)c4)nc(-c4cccc(-c5ccccc5)c4)n3)c2-c2ccc3c(-c4ccccc4)cccc3c21

nearest known ligand 0.33

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA12 O43570 1/20 0.32
▸ CA1 P00915 1/20 0.32
▸ CA2 P00918 1/20 0.32
▸ CA9 Q16790 1/20 0.32
▸ PDE7A Q13946 2/20 0.31
▸ PDE7B Q9NP56 2/20 0.31
▸ NR1I3 Q14994 3/20 0.31
▸ CYP1A2 P05177 1/20 0.31
▸ CYP3A4 P08684 1/20 0.31
▸ VDR P11473 1/20 0.31
▸ CYP2C9 P11712 1/20 0.31
▸ CYP2B6 P20813 1/20 0.31
▸ AHR P35869 1/20 0.31
▸ RARA P10276 1/20 0.31
▸ RARB P10826 1/20 0.31
▸ RARG P13631 1/20 0.31
▸ PDK2 Q15119 2/20 0.31
▸ GP6 Q9HCN6 1/20 0.31
▸ TNF P01375 1/20 0.31
▸ POLB P06746 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
SCHEMBL23743372 0.89 TSHR (0.36) CA12CA1CA2CA9PDE7A
SCHEMBL22038469 0.88 SMN1; SMN2 (0.35) CA12CA1CA2CA9PDE7A
SCHEMBL22868816 0.87 PDK2 (0.36) CA12CA1CA2CA9PDE7A
SCHEMBL23743378 0.86 MAPT (0.38) CYP1A2CYP3A4CYP2C9TNF
SCHEMBL22868983 0.86 AURKA (0.33) PDE7APDE7BCYP1A2CYP3A4CYP2C9
SCHEMBL23743373 0.86 ESR1 (0.36) CYP1A2CYP3A4CYP2C9CYP2B6RARA
SCHEMBL22868937 0.85 PDK2 (0.35) NR1I3CYP1A2CYP3A4VDRCYP2C9
SCHEMBL23743371 0.84 PDK2 (0.34) RARARARBRARGPDK2
SCHEMBL23743379 0.84 AURKA (0.35) CA12CA1CA2CA9PDE7A
SCHEMBL22868815 0.84 L3MBTL1 (0.35) NR1I3CYP1A2CYP3A4VDRCYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210249607-A1 COMPOUND FOR ORGANIC OPTOELECTRONIC DEVICE, COMPOSITION FOR ORGANIC OPTOELECTRONIC DEVICE, ORGANIC OPTOELECTRONIC DEVICE AND DISPLAY DEVICE SAMSUNG SDI CO., LTD. (KR) 2021-08-12 — — 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-20210249607-A1 COMPOUND FOR ORGANIC OPTOELECTRONIC DEVICE, COMPOSITION FOR ORGANIC OPTOELECTRONIC DEVICE, ORGANIC OPTOELECTRONIC DEVICE AND DISPLAY DEVICE OCIAD2, OCIAD1, OXER1 CA12 737/4885CA1 2509/4885CA2 1860/4885

“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.

Send feedback