SCHEMBL20930834

SCHEMBL20930834

CCOC(=O)C(c1ccc(Br)cc1)C(C(=O)OCC)c1ccc(Br)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.50
MAPT P10636 2/20 0.50
LMNA P02545 2/20 0.50
NPSR1 Q6W5P4 2/20 0.50
MEN1 O00255 1/20 0.50
S1PR4 O95977 1/20 0.50
S1PR1 P21453 1/20 0.50
MAPK1 P28482 1/20 0.50
ALDH1A1 P00352 2/20 0.46
HPGD P15428 1/20 0.46
CYP1A2 P05177 2/20 0.46
HTT P42858 1/20 0.45
MMP8 P22894 1/20 0.45
GAA P10253 2/20 0.43
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
TARBP2 Q15633 1/20 0.42
KDM4E B2RXH2 1/20 0.41
TDP1 Q9NUW8 1/20 0.41

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
SCHEMBL7171 0.93 MAPT (0.45) KMT2AMAPTLMNANPSR1MEN1
SCHEMBL31482742 0.91 KMT2A (0.44) KMT2AMAPTLMNANPSR1MEN1
SCHEMBL536847 0.86 MMP8 (0.56) KMT2AMAPTLMNANPSR1MEN1
SCHEMBL11598177 0.86 LMNA (0.49) KMT2AMAPTLMNANPSR1MEN1
SCHEMBL898279 0.85 MAPT (0.47) KMT2AMAPTLMNANPSR1MEN1
SCHEMBL324361 0.85 KMT2A (0.47) KMT2AMAPTLMNANPSR1MEN1
SCHEMBL7029 0.85 CYP1A2 (0.49) KMT2AMAPTLMNANPSR1MEN1
SCHEMBL2554850 0.84 MAPT (0.47) KMT2AMAPTLMNANPSR1MEN1
SCHEMBL31198054 0.83 MAPT (0.46) KMT2AMAPTLMNANPSR1MEN1
SCHEMBL18610656 0.83 MAPT (0.46) KMT2AMAPTLMNANPSR1MEN1

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-20200235304-A1 NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING SAME LG CHEM, LTD. (KR) 2020-07-23 US disclosed
WO-2019078620-A1 NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE USING SAME 주식회사 엘지화학 2019-04-25 WO 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-20200235304-A1 NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING SAME C1S, CBR3, CCNL2 KMT2A 3197/4885MAPT 4043/4885LMNA 1168/4885

“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.