SCHEMBL2185809

SCHEMBL2185809

O=C(O)c1cccc(NCc2ccccc2)c1

nearest known ligand 0.90

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 2/20 0.70
MRGPRX4 Q96LA9 1/20 0.68
HIF1A Q16665 1/20 0.68
RAB9A P51151 3/20 0.66
NPC1 O15118 2/20 0.66
MITF O75030 1/20 0.66
MAPK1 P28482 1/20 0.66
KMT2A Q03164 1/20 0.66
AKR1C3 P42330 1/20 0.66
PPARA Q07869 8/20 0.62
KDM4E B2RXH2 1/20 0.61
HDAC8 Q9BY41 1/20 0.60
HDAC6 Q9UBN7 1/20 0.60

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
SCHEMBL15458722 0.95 HIF1A (0.67) FFAR1MRGPRX4HIF1ARAB9ANPC1
SCHEMBL10055040 0.95 FFAR1 (0.68) FFAR1MRGPRX4HIF1AAKR1C3PPARA
SCHEMBL14758954 0.93 FFAR1 (0.70) FFAR1MRGPRX4HIF1ARAB9ANPC1
SCHEMBL12581587 0.93 MRGPRX4 (0.73) FFAR1MRGPRX4HIF1ARAB9ANPC1
SCHEMBL1287947 0.90 HIF1A (0.83) FFAR1MRGPRX4HIF1ARAB9ANPC1
SCHEMBL27488835 0.87 FFAR1 (0.67) FFAR1MRGPRX4HIF1ARAB9ANPC1
SCHEMBL17131810 0.87 MEN1 (0.58) FFAR1MRGPRX4HIF1AKMT2AAKR1C3
SCHEMBL2188996 0.87 PPARA (0.79) FFAR1MRGPRX4RAB9ANPC1KMT2A
SCHEMBL21370450 0.86 PPARA (0.84) FFAR1RAB9ANPC1KMT2APPARA
SCHEMBL13802457 0.86 MRGPRX4 (0.63) FFAR1MRGPRX4HIF1ARAB9ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2342177-B1 NOVEL POTASSIUM CHANNEL BLOCKERS JAPAN TOBACCO INC (JP) 2017-02-15 EP disclosed
US-9447033-B2 Potassium channel blockers JAPAN TOBACCO INC. (JP) 2016-09-20 US disclosed
US-20150259282-A1 Potassium Channel Blockers XENTION LIMITED (GB) 2015-09-17 US disclosed
US-9073834-B2 Potassium channel blockers XENTION LIMITED (GB) 2015-07-07 US disclosed
US-20140221337-A1 Potassium Channel Blockers XENTION LIMITED (GB) 2014-08-07 US disclosed
US-8673901-B2 Potassium channel blockers XENTION LIMITED (GB) 2014-03-18 US disclosed
US-20120183498-A1 COMPOUNDS, COMPOSITIONS AND METHODS FOR TREATING OR PREVENTING PNEUMOVIRUS INFECTION AND ASSOCIATED DISEASES NITZ THEODORE J (US) 2012-07-19 US disclosed
EP-2342177-A1 NOVEL POTASSIUM CHANNEL BLOCKERS Xention Limited (GB) 2011-07-13 EP disclosed
US-20100087428-A1 Novel Potassium Channel Blockers XENTION LIMITED (GB) 2010-04-08 US disclosed
WO-2010023448-A1 NOVEL POTASSIUM CHANNEL BLOCKERS XENTION LIMITED (GB) 2010-03-04 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 (4 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-20140221337-A1 Potassium Channel Blockers KCNJ2, KCNH2, KCNB1 FFAR1 1688/4885MRGPRX4 308/4885HIF1A 3449/4885
US-20100087428-A1 Novel Potassium Channel Blockers HCN4, SCN2B, KCNH2 FFAR1 209/4885MRGPRX4 271/4885HIF1A 4014/4885
US-20150259282-A1 Potassium Channel Blockers KCNJ2, KCNH2, KCNB1 FFAR1 1688/4885MRGPRX4 308/4885HIF1A 3449/4885
US-20120183498-A1 COMPOUNDS, COMPOSITIONS AND METHODS FOR TREATING OR PREVENTING PNEUMOVIRUS INFECTION AND ASSOCIATED DISEASES TTPA, HAVCR2, ZC3HAV1 FFAR1 4762/4885MRGPRX4 1114/4885HIF1A 731/4885

“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.