SCHEMBL18878243

SCHEMBL18878243

O=C(O)c1cc(Br)cc2c1ccc1c(C(=O)O)cc(Br)cc12

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.62
KMT2A Q03164 4/20 0.62
RXFP1 Q9HBX9 4/20 0.62
AKR1C3 P42330 2/20 0.52
AKR1C2 P52895 2/20 0.52
AKR1C1 Q04828 2/20 0.52
AKR1C4 P17516 1/20 0.52
KDM4E B2RXH2 2/20 0.50
GLA P06280 1/20 0.50
HSD17B10 Q99714 3/20 0.46
NPC1 O15118 1/20 0.44
MYC P01106 1/20 0.42
NR4A1 P22736 1/20 0.42
EPRS1 P07814 2/20 0.41
GRIN1 Q05586 1/20 0.41
GRIN2A Q12879 1/20 0.41
GRIN2B Q13224 1/20 0.41
GRIN2C Q14957 1/20 0.41
GPR35 Q9HC97 1/20 0.41
PPARG P37231 2/20 0.40

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
SCHEMBL30474627 0.86 MEN1 (0.50) MEN1KMT2ARXFP1AKR1C3AKR1C2
SCHEMBL18878467 0.86 MEN1 (0.50) MEN1KMT2ARXFP1AKR1C3AKR1C2
SCHEMBL11430696 0.82 PRNP (0.57) MEN1KMT2ARXFP1AKR1C3AKR1C2
SCHEMBL18875282 0.82 MEN1 (0.47) MEN1KMT2ARXFP1AKR1C3AKR1C2
SCHEMBL31401779 0.80 MEN1 (0.61) MEN1KMT2ARXFP1KDM4EGLA
SCHEMBL29001033 0.80 MEN1 (0.61) MEN1KMT2ARXFP1KDM4EGLA
SCHEMBL18875285 0.78 MEN1 (0.43) MEN1KMT2ARXFP1AKR1C3AKR1C2
SCHEMBL2853503 0.78 MEN1 (1.00) MEN1KMT2ARXFP1KDM4EGLA
SCHEMBL6437956 0.75 AKR1C3 (0.60) AKR1C3AKR1C2AKR1C1AKR1C4KDM4E
SCHEMBL1228020 0.75 MEN1 (0.65) MEN1KMT2ARXFP1AKR1C3AKR1C2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170148996-A1 ORGANIC ELECTROLUMINESCENT COMPOUNDS AND ORGANIC OPTOELECTRONIC DEVICES COMPRISING THE SAME WUHAN TIANMA MICROELECTRONICS CO., LTD.SHANGHAI BRANCH (CN) 2017-05-25 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-20170148996-A1 ORGANIC ELECTROLUMINESCENT COMPOUNDS AND ORGANIC OPTOELECTRONIC DEVICES COMPRISING THE SAME OR10J3, PPOX, OR51E2 MEN1 4232/4885KMT2A 3013/4885RXFP1 4764/4885

“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.