SCHEMBL14329580

SCHEMBL14329580

Fc1ccc(-n2c3cccnc3c3c4ccc5cc6c(c7ccc(cc32)c4c57)c2ncccc2n6-c2ccc(F)cc2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 1/20 0.36
▸ REN P00797 3/20 0.35
▸ CYP19A1 P11511 1/20 0.34
▸ EP300 Q09472 1/20 0.34
▸ CREBBP Q92793 1/20 0.34
▸ KAT2A Q92830 1/20 0.34
▸ KAT2B Q92831 1/20 0.34
▸ ADORA3 P0DMS8 2/20 0.34
▸ MAPK14 Q16539 1/20 0.34
▸ HKDC1 Q2TB90 1/20 0.34
▸ KDM4E B2RXH2 3/20 0.33
▸ TOP1 P11387 2/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ HSP90AA1 P07900 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ HTT P42858 1/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL14329605 0.88 KDM4E (0.41) RENADORA3KDM4EL3MBTL1LMNA
SCHEMBL14329571 0.88 KDM4E (0.40) RENKDM4EL3MBTL1LMNAHSP90AA1
SCHEMBL14329618 0.86 KDM4E (0.33) RENADORA3MAPK14KDM4EL3MBTL1
SCHEMBL14329583 0.86 ALDH1A1 (0.35) RENKDM4ETOP1L3MBTL1HSP90AA1
SCHEMBL14329610 0.84 ALDH1A1 (0.33) HPGDADORA3KDM4EL3MBTL1LMNA
SCHEMBL14329597 0.84 MAPK10 (0.38) HPGDCYP19A1KDM4EL3MBTL1LMNA
SCHEMBL14330495 0.84 CYP1A2 (0.40) HPGDKDM4EL3MBTL1LMNAHSP90AA1
SCHEMBL14329599 0.83 MAPT (0.35) HPGDCYP19A1KDM4EL3MBTL1LMNA
SCHEMBL14329606 0.83 REN (0.31) RENKDM4EL3MBTL1
SCHEMBL14329584 0.82 KDM4E (0.42) RENKDM4EL3MBTL1MAPT

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-8771844-B2 Heterocyclic compound and organic light-emitting diode and flat display device including the heterocyclic compound SAMSUNG DISPLAY CO., LTD. (KR) 2014-07-08 — — US disclosed
US-8771844-B2 Heterocyclic compound and organic light-emitting diode and flat display device including the heterocyclic compound SAMSUNG DISPLAY CO., LTD. (KR) 2014-07-08 — — US disclosed
US-20120326135-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-20120326135-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-20120326135-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DIODE AND FLAT DISPLAY DEVICE INCLUDING THE HETEROCYCLIC COMPOUND DDT, DRD1, HTR3D HPGD 483/4885REN 3539/4885CYP19A1 57/4885

“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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