SCHEMBL23348405

SCHEMBL23348405

CC(C)(C)c1ccc2c(c1)c1ccc(C(C)(C)C)cc1n2-c1cccc(-n2c3ccc(C(C)(C)C)cc3c3ccc(C(C)(C)C)cc32)c1C#N

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.36
MAPT P10636 1/20 0.36
PGR P06401 2/20 0.35
AR P10275 1/20 0.35
CYP1A2 P05177 2/20 0.34
CYP2C19 P33261 2/20 0.34
CYP3A4 P08684 1/20 0.34
GAA P10253 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C9 P11712 1/20 0.34
RORC P51449 2/20 0.33
RORA P35398 1/20 0.33
RORB Q92753 1/20 0.33
HTR1D P28221 1/20 0.33
KIF11 P52732 4/20 0.32
NOTUM Q6P988 1/20 0.32
DHODH Q02127 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.31
HIF1A Q16665 1/20 0.31
KCNJ5 P48544 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
SCHEMBL13912251 0.96 MAPT (0.39) ALDH1A1MAPTPGRARCYP1A2
SCHEMBL23348323 0.89 SMN1; SMN2 (0.39) ALDH1A1MAPTGAAKIF11DHODH
SCHEMBL23348299 0.88 HTR1D (0.32) PGRARHTR1DKIF11DHODH
SCHEMBL13071216 0.87 ALDH1A1 (0.33) ALDH1A1MAPT
SCHEMBL23348403 0.86 KCNH2 (0.35) PGRARHTR1DKIF11DHODH
SCHEMBL28766698 0.86 SMN1; SMN2 (0.45) ALDH1A1MAPTPGRARCYP1A2
SCHEMBL23348409 0.86 KIF11 (0.34) ALDH1A1MAPTPGRGAARORC
SCHEMBL23348315 0.85 KIF11 (0.38) MAPTPGRARCYP1A2CYP2C19
SCHEMBL23348330 0.84 EGLN2 (0.33) HTR1DKCNJ5KCNJ3KCNQ1CACNA1C
SCHEMBL23348443 0.84 KCNJ5 (0.30) HTR1DKCNJ5KCNJ3KCNQ1CACNA1C

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-20210139425-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME SAMSUNG DISPLAY CO., LTD. (KR) 2021-05-13 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-20210139425-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME CCND2, CCND1, CRY1 ALDH1A1 88/4885MAPT 1531/4885PGR 2039/4885

“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.