SCHEMBL15427902

SCHEMBL15427902

O=Cc1ccccc1C#CC(F)(F)F

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.44
▸ KMT2A Q03164 2/20 0.44
▸ MEN1 O00255 1/20 0.44
▸ THRB P10828 1/20 0.44
▸ BLM P54132 1/20 0.44
▸ TDP1 Q9NUW8 1/20 0.44
▸ ALDH1A1 P00352 2/20 0.38
▸ TSHR P16473 1/20 0.38
▸ TRIM24 O15164 1/20 0.38
▸ TRIM33 Q9UPN9 1/20 0.38
▸ HPGD P15428 1/20 0.34
▸ HTT P42858 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ ERN1 O75460 2/20 0.33
▸ GAA P10253 1/20 0.32
▸ SRC P12931 1/20 0.31
▸ NFKB1 P19838 1/20 0.30

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
SCHEMBL15427894 0.81 LMNA (0.44) LMNAKMT2AMEN1THRBBLM
SCHEMBL13471396 0.79 ALDH1A1 (0.33) KMT2AMEN1ALDH1A1TSHRHPGD
SCHEMBL9527225 0.78 LMNA (0.41) LMNAKMT2AMEN1THRBBLM
SCHEMBL15675346 0.75 KMT2A (0.39) LMNAKMT2AMEN1THRBBLM
SCHEMBL18425025 0.74 FFAR1 (0.39) LMNAKMT2AMEN1THRBBLM
SCHEMBL31587369 0.74 MEN1 (0.50) LMNAKMT2AMEN1THRBBLM
SCHEMBL9699037 0.74 LMNA (0.50) LMNAKMT2AMEN1THRBBLM
SCHEMBL6103008 0.73 LMNA (0.44) LMNAKMT2AMEN1THRBBLM
SCHEMBL18253198 0.73 MEN1 (0.36) LMNAKMT2AMEN1THRBBLM
SCHEMBL29880146 0.72 KMT2A (0.48) LMNAKMT2AMEN1THRBBLM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9837622-B2 Metal complexes MERCK PATENT GMBH (DE) 2017-12-05 — — US disclosed
US-9837622-B2 Metal complexes MERCK PATENT GMBH (DE) 2017-12-05 — — US disclosed
US-20150263297-A1 Metal Complexes MERCK PATENT GMBH (DE) 2015-09-17 — — US disclosed
US-20150263297-A1 Metal Complexes MERCK PATENT GMBH (DE) 2015-09-17 — — US disclosed
WO-2014008982-A1 METAL COMPLEXES MERCK PATENT GMBH (DE) 2014-01-16 — — 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-20150263297-A1 Metal Complexes SOD1, AP1M1, AP3M1 LMNA 4436/4885KMT2A 2922/4885MEN1 989/4885

“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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