SCHEMBL14331578

SCHEMBL14331578

COc1cc(OC)cc(-n2c3cnccc3c3c4ccc5ccc(-c6ccccc6)c6ccc(cc32)c4c56)c1

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MGAT2 Q10469 1/20 0.38
▸ METAP2 P50579 1/20 0.37
▸ CYP11B1 P15538 4/20 0.36
▸ CYP11B2 P19099 4/20 0.36
▸ CYP17A1 P05093 3/20 0.36
▸ CYP3A4 P08684 1/20 0.36
▸ DGAT2 Q96PD7 7/20 0.36
▸ DYRK1A Q13627 1/20 0.35
▸ G6PD P11413 1/20 0.35
▸ HASPIN Q8TF76 1/20 0.34
▸ BRAF P15056 1/20 0.34
▸ MAPK14 Q16539 1/20 0.34
▸ TNF P01375 1/20 0.34
▸ CYP19A1 P11511 1/20 0.34

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
SCHEMBL14330583 0.94 MGAT2 (0.35) MGAT2METAP2CYP11B1CYP11B2CYP17A1
SCHEMBL14331577 0.92 MGAT2 (0.38) MGAT2METAP2CYP11B1CYP11B2CYP17A1
SCHEMBL14330549 0.86 MGAT2 (0.35) MGAT2METAP2CYP11B1CYP11B2CYP17A1
SCHEMBL14330589 0.84 DYRK1A (0.37) DYRK1AHASPINTNFCYP19A1
SCHEMBL14331584 0.82 TOP1 (0.40) METAP2
SCHEMBL14331114 0.81 CDK4 (0.42) CYP11B1CYP11B2CYP3A4DYRK1AG6PD
SCHEMBL14330586 0.81 DYRK1A (0.36) CYP11B1CYP11B2CYP17A1CYP3A4DYRK1A
SCHEMBL14330575 0.81 CDK4 (0.35) METAP2DYRK1AHASPINTNF
SCHEMBL14330593 0.81 DYRK1A (0.37) DYRK1ATNF
SCHEMBL14329625 0.80 CDK4 (0.39) DYRK1A

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-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

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 MGAT2 2806/4885METAP2 3997/4885CYP11B1 842/4885

“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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