SCHEMBL14330577

SCHEMBL14330577

CC1(C)c2ccccc2-c2ccc(-n3c4cnccc4c4c5ccc6ccc(-c7ccc8ccccc8c7)c7ccc(cc43)c5c67)cc21

nearest known ligand 0.32

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ PIK3CD O00329 2/20 0.32
▸ PIK3CB P42338 1/20 0.32
▸ PIK3CG P48736 1/20 0.32
▸ CCNC P24863 2/20 0.32
▸ CDK8 P49336 2/20 0.32
▸ MAPK9 P45984 5/20 0.31
▸ MAPK10 P53779 5/20 0.31
▸ MET P08581 1/20 0.31
▸ TDO2 P48775 2/20 0.31
▸ SLC22A12 Q96S37 1/20 0.30
▸ MAPK8 P45983 2/20 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
SCHEMBL14330541 0.93 PIK3CD (0.32) PIK3CDPIK3CBPIK3CGCCNCCDK8
SCHEMBL14330574 0.91 CDK4 (0.30) MAPK9MAPK10
SCHEMBL14330582 0.90 PIK3CD (0.33) PIK3CDPIK3CBPIK3CG
SCHEMBL14330494 0.84 AKT1 (0.33) MET
SCHEMBL14330587 0.84 — —
SCHEMBL14330537 0.84 TOP2A (0.30) MAPK9MAPK10
SCHEMBL14329613 0.83 TOP2A (0.32) MAPK9MAPK10
SCHEMBL14330544 0.83 PIK3CD (0.31) PIK3CDPIK3CBPIK3CG
SCHEMBL16788674 0.79 ERBB2 (0.33) —
SCHEMBL14330591 0.77 CDK4 (0.30) —

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-8623521-B2 Heterocyclic compound and organic light-emitting diode and flat display device including the heterocyclic compound SAMSUNG DISPLAY CO., LTD. (KR) 2014-01-07 — — US disclosed
US-8623521-B2 Heterocyclic compound and organic light-emitting diode and flat display device including the heterocyclic compound SAMSUNG DISPLAY CO., LTD. (KR) 2014-01-07 — — US disclosed
US-20120326134-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DIODE AND FLAT DISPLAY DEVICE INCLUDING THE HETEROCYCLIC COMPOUND SAMSUNG DISPLAY CO., LTD. (KR) 2012-12-27 — — US disclosed
US-20120326134-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DIODE AND FLAT DISPLAY DEVICE INCLUDING THE HETEROCYCLIC COMPOUND SAMSUNG DISPLAY CO., LTD. (KR) 2012-12-27 — — 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-20120326134-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DIODE AND FLAT DISPLAY DEVICE INCLUDING THE HETEROCYCLIC COMPOUND DDT, DRD1, HTR3D PIK3CD 2912/4885PIK3CB 3872/4885PIK3CG 4087/4885

“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.

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