SCHEMBL46184

SCHEMBL46184

CC(C)(C)c1ccc(C(=O)NNC(=O)c2ccc(Br)cc2)cc1

nearest known ligand 0.71

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.71
KMT2A Q03164 3/20 0.71
SMN1; SMN2 Q16637 2/20 0.71
POLB P06746 3/20 0.68
HDAC1 Q13547 3/20 0.66
MAPT P10636 2/20 0.64
RAB9A P51151 3/20 0.62
CTDSP1 Q9GZU7 1/20 0.57
ALDH1A1 P00352 4/20 0.56
LMNA P02545 1/20 0.56
GAA P10253 1/20 0.56
UBE2N P61088 1/20 0.56
NPC1 O15118 1/20 0.56
HPGD P15428 1/20 0.55
HDAC3 O15379 3/20 0.54
HDAC8 Q9BY41 2/20 0.54
HDAC6 Q9UBN7 2/20 0.54
HDAC2 Q92769 2/20 0.54
HDAC11 Q96DB2 1/20 0.54

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
SCHEMBL14438185 0.90 POLB (0.81) MEN1KMT2ASMN1; SMN2POLBHDAC1
SCHEMBL1982518 0.85 POLB (0.68) MEN1KMT2ASMN1; SMN2POLBHDAC1
SCHEMBL13481186 0.85 POLB (0.68) MEN1KMT2ASMN1; SMN2POLBHDAC1
SCHEMBL2685393 0.84 SRD5A2 (0.68) MEN1KMT2ASMN1; SMN2POLBHDAC1
SCHEMBL7296335 0.84 HDAC6 (0.78) MEN1KMT2ASMN1; SMN2RAB9ANPC1
SCHEMBL1982935 0.84 HDAC6 (0.78) MEN1KMT2ASMN1; SMN2RAB9ANPC1
SCHEMBL5122776 0.83 POLB (0.56) MEN1KMT2ASMN1; SMN2POLBHDAC1
SCHEMBL7175399 0.81 POLB (0.68) MEN1KMT2ASMN1; SMN2POLBHDAC1
SCHEMBL13605085 0.80 MAPT (0.63) MEN1KMT2ASMN1; SMN2POLBHDAC1
SCHEMBL17680509 0.80 POLB (0.53) MEN1KMT2ASMN1; SMN2POLBHDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9598450-B2 Emissive compounds for organic light-emitting diodes NITTO DENKO CORPORATION (JP) 2017-03-21 US disclosed
US-9598450-B2 Emissive compounds for organic light-emitting diodes NITTO DENKO CORPORATION (JP) 2017-03-21 US disclosed
US-9598450-B2 Emissive compounds for organic light-emitting diodes NITTO DENKO CORPORATION (JP) 2017-03-21 US disclosed
US-20130087772-A1 EMISSIVE COMPOUNDS FOR ORGANIC LIGHT-EMITTING DIODES NITTO DENKO CORPORATION (JP) 2013-04-11 US disclosed
US-20130087772-A1 EMISSIVE COMPOUNDS FOR ORGANIC LIGHT-EMITTING DIODES NITTO DENKO CORPORATION (JP) 2013-04-11 US disclosed
US-20130087772-A1 EMISSIVE COMPOUNDS FOR ORGANIC LIGHT-EMITTING DIODES NITTO DENKO CORPORATION (JP) 2013-04-11 US disclosed
WO-2011149500-A1 EMISSIVE COMPOUNDS FOR ORGANIC LIGHT-EMITTING DIODES NITTO DENKO CORPORATION (JP) 2011-12-01 WO disclosed
CN-101139317-B Organic semiconductor material containing carbazole unit and synthesis UNIV NANJING POSTS & TELECOMM 2011-09-07 CN disclosed
CN-101139317-A Organic semiconductor material containing carbazole unit and synthesis UNIV NANJING POSTS & TELECOMM (CN) 2008-03-12 CN 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-20130087772-A1 EMISSIVE COMPOUNDS FOR ORGANIC LIGHT-EMITTING DIODES CRY2, PPOX, CRY1 MEN1 1749/4885KMT2A 608/4885SMN1; SMN2 4139/4885

“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.