SCHEMBL6048481

SCHEMBL6048481

O=C(COC(F)(F)F)Nc1ccc(Br)cc1

nearest known ligand 0.63

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.63
KMT2A Q03164 6/20 0.59
MEN1 O00255 5/20 0.59
MAPK1 P28482 2/20 0.52
SMN1; SMN2 Q16637 3/20 0.50
ALDH1A1 P00352 2/20 0.50
TDP1 Q9NUW8 1/20 0.49
NPC1 O15118 4/20 0.47
RAB9A P51151 4/20 0.47
MAPT P10636 2/20 0.47
GBA1 P04062 1/20 0.47
POLB P06746 1/20 0.47
LMNA P02545 1/20 0.46
HTT P42858 1/20 0.46

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
SCHEMBL7685097 0.83 MAPT (0.54) HPGDKMT2AMEN1MAPK1ALDH1A1
SCHEMBL20548265 0.80 MEN1 (0.66) HPGDKMT2AMEN1MAPK1ALDH1A1
SCHEMBL971460 0.77 HPGD (1.00) HPGDKMT2AMEN1MAPK1SMN1; SMN2
SCHEMBL28535465 0.77 KMT2A (0.66) HPGDKMT2AMEN1SMN1; SMN2ALDH1A1
SCHEMBL1771192 0.76 KMT2A (0.69) HPGDKMT2AMEN1SMN1; SMN2ALDH1A1
SCHEMBL11712354 0.76 KMT2A (0.63) HPGDKMT2AMEN1SMN1; SMN2ALDH1A1
SCHEMBL16140981 0.76 KMT2A (1.00) HPGDKMT2AMEN1SMN1; SMN2ALDH1A1
SCHEMBL6607271 0.75 ALDH1A1 (0.71) HPGDKMT2AMEN1MAPK1SMN1; SMN2
SCHEMBL7445670 0.74 KMT2A (0.73) HPGDKMT2AMEN1SMN1; SMN2ALDH1A1
SCHEMBL31490978 0.74 MEN1 (0.55) KMT2AMEN1SMN1; SMN2ALDH1A1NPC1

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
EP-1202953-B1 SUBSTITUTED 2-DIALKYLAMINOALKYLBIPHENYL DERIVATIVES GRUENENTHAL GMBH (DE) 2006-08-30 EP disclosed
US-20020198251-A1 Substituted 2-dialkylaminoalkylbiphenyl derivatives GRUENENTHAL GMBH (DE) 2002-12-26 US disclosed
EP-1202953-A2 SUBSTITUTED 2-DIALKYLAMINOALKYLBIPHENYL DERIVATIVES Grünenthal GmbH (DE) 2002-05-08 EP disclosed
WO-2001010816-A2 SUBSTITUTED 2-DIALKYLAMINOALKYLBIPHENYL DERIVATIVES Grünenthal GmbH (DE) 2001-02-15 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-20020198251-A1 Substituted 2-dialkylaminoalkylbiphenyl derivatives LIPA, PKD1, PKD2 HPGD 1133/4885KMT2A 2689/4885MEN1 2982/4885

“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.