SCHEMBL1424877

SCHEMBL1424877

O=C(NC1CCN(C(=O)c2ccccc2)CC1)c1ccc(F)cc1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.73
MEN1 O00255 1/20 0.73
EPHX1 P07099 1/20 0.68
SLC6A12 P48065 1/20 0.65
TMEM97 Q5BJF2 1/20 0.65
MCHR1 Q99705 1/20 0.65
SIGMAR1 Q99720 1/20 0.65
HSD11B1 P28845 2/20 0.65
POLB P06746 2/20 0.64
PRKAB2 O43741 1/20 0.62
PRKAG1 P54619 1/20 0.62
PRKAA2 P54646 1/20 0.62
PRKAA1 Q13131 1/20 0.62
PRKAG3 Q9UGI9 1/20 0.62
PRKAG2 Q9UGJ0 1/20 0.62
PRKAB1 Q9Y478 1/20 0.62
EPHX2 P34913 1/20 0.60
CCR3 P51677 1/20 0.59
NPC1 O15118 1/20 0.58
RAB9A P51151 1/20 0.58

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
SCHEMBL8538835 0.86 EPHX2 (0.65) KMT2AMEN1EPHX1HSD11B1POLB
SCHEMBL8738923 0.84 MEN1 (0.70) KMT2AMEN1EPHX1POLBEPHX2
SCHEMBL28403250 0.83 KMT2A (0.57) KMT2AMEN1SLC6A12TMEM97MCHR1
SCHEMBL1424870 0.83 HSD11B1 (0.69) KMT2AMEN1EPHX1HSD11B1EPHX2
Fk-962 SCHEMBL239762 0.82 KMT2A (0.69) KMT2AMEN1SLC6A12TMEM97MCHR1
SCHEMBL995119 0.81 POLB (0.66) KMT2AMEN1EPHX1MCHR1POLB
SCHEMBL4369698 0.81 EPHX1 (0.82) KMT2AMEN1EPHX1SIGMAR1HSD11B1
SCHEMBL5145670 0.81 EPHX1 (1.00) KMT2AMEN1EPHX1SIGMAR1POLB
SCHEMBL6539130 0.81 KMT2A (0.67) KMT2AMEN1SLC6A12TMEM97MCHR1
SCHEMBL28406359 0.80 EPHX1 (0.66) KMT2AMEN1EPHX1POLBEPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1140836-B1 AMIDE COMPOUNDS ASTELLAS PHARMA INC (JP) 2011-03-23 EP disclosed
US-20040092528-A1 Agent for modulating excitatory synaptic transmission comprising a compound having alpha7 nicotinic acetylcholine receptor activation property FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-05-13 US disclosed
CN-1142910-C Amide compound ����ҩƷ��ҵ��ʽ���� 2004-03-24 CN disclosed
US-6710043-B1 POSSESS THE POTENTIATION OF THE CHOLINERGIC ACTIVITY FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2004-03-23 US disclosed
US-20040014745-A1 Amide compounds FUJISAWA PHARMACEUTICAL CO. LTD. (JP) 2004-01-22 US disclosed
EP-1315494-A1 AGENT FOR MODULATING EXCITATORY SYNAPTIC TRANSMISSION COMPRISING A COMPOUND HAVING ALPHA-7 NICOTINIC ACETYLCHOLINE RECEPTOR ACTIVATION PROPERTY FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2003-06-04 EP disclosed
EP-1235575-A2 AGENT FOR EXPRESSION OF LONG-TERM POTENTIATION OF SYNAPTIC TRANSMISSION COMPRISING COMPOUND HAVING BRAIN SOMATOSTATIN ACTIVATION PROPERTY FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2002-09-04 EP disclosed
WO-2002020016-A1 AGENT FOR MODULATING EXCITATORY SYNAPTIC TRANSMISSION COMPRISING A COMPOUND HAVING ALPHA α7 NICOTINIC ACETYLCHOLINE RECEPTOR ACTIVATION PROPERTY FUJISAWA PHARMACEUTICAL CO, LTD (JP) 2002-03-14 WO disclosed
CN-1336917-A Amide compounds FUJISAWA PHARMACEUTICAL CO (JP) 2002-02-20 CN disclosed
WO-2000072834-A9 AGENT FOR EXPRESSION OF LONG-TERM POTENTIATION OF SYNAPTIC TRANSMISSION COMPRISING COMPOUND HAVING BRAIN SOMATOSTATIN ACTIVATION PROPERTY FUJISAWA PHARMACEUTICAL CO (JP) 2001-12-20 WO disclosed
EP-1140836-A1 AMIDE COMPOUNDS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2001-10-10 EP disclosed
WO-2000072834-A2 AGENT FOR EXPRESSION OF LONG-TERM POTENTIATION OF SYNAPTIC TRANSMISSION COMPRISING COMPOUND HAVING BRAIN SOMATOSTATIN ACTIVATION PROPERTY FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2000-12-07 WO disclosed
WO-2000042011-A1 AMIDE COMPOUNDS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2000-07-20 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 (2 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-20040014745-A1 Amide compounds CHRM1, CHRM2, CHRNE KMT2A 1224/4885MEN1 1551/4885EPHX1 869/4885
US-20040092528-A1 Agent for modulating excitatory synaptic transmission comprising a compound having alpha7 nicotinic acetylcholine receptor activation property CHRNA7, CHRNA5, CHRNA10 KMT2A 4093/4885MEN1 1925/4885EPHX1 1266/4885

“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.