SCHEMBL2511206

SCHEMBL2511206

CC(C)c1nc(I)cn1Cc1ccc(Cl)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 2/20 0.39
CYP11B2 P19099 2/20 0.39
MAPK1 P28482 2/20 0.39
HTT P42858 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
KCNH2 Q12809 2/20 0.39
KMT2A Q03164 2/20 0.38
HTR6 P50406 1/20 0.36
SLC6A2 P23975 1/20 0.36
SLC6A3 Q01959 1/20 0.36
KDM4E B2RXH2 2/20 0.35
ALDH1A1 P00352 1/20 0.35
ALOX5AP P20292 1/20 0.34
MAPT P10636 2/20 0.34
THRB P10828 1/20 0.34
DBH P09172 1/20 0.34
POLB P06746 1/20 0.34
GALR3 O60755 1/20 0.34
NR2F2 P24468 1/20 0.34
RAB9A P51151 1/20 0.34

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
SCHEMBL28012977 0.83 KCNH2 (0.40) CYP11B1CYP11B2MAPK1HTTSMN1; SMN2
SCHEMBL2510755 0.78 SLC6A2 (0.37) CYP11B1CYP11B2MAPK1HTTSMN1; SMN2
SCHEMBL2512773 0.72 HTR6 (0.44) MAPK1HTTSMN1; SMN2KCNH2KMT2A
SCHEMBL27963398 0.71 KCNH2 (0.63) SMN1; SMN2KCNH2KMT2AALDH1A1LMNA
SCHEMBL13187206 0.64 ALOX5AP (0.69) KCNH2KMT2ASLC6A3ALDH1A1ALOX5AP
SCHEMBL10248963 0.62 POLB (0.49) HTTSMN1; SMN2KMT2ASLC6A2SLC6A3
SCHEMBL13800892 0.62 KCNH2 (0.50) MAPK1HTTSMN1; SMN2KCNH2KMT2A
SCHEMBL22185256 0.61 CYP11B1 (0.45) CYP11B1CYP11B2MAPK1HTTSMN1; SMN2
SCHEMBL18925230 0.61 NOTUM (0.55) KMT2ARAB9AMEN1
SCHEMBL5983769 0.60 KCNH2 (0.43) CYP11B1CYP11B2MAPK1HTTSMN1; SMN2

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
US-8399444-B2 Bicyclic imidazole as DP1 receptor antagonists GlaxoSmithKline Intellectual Property Development Ltd. (GB) 2013-03-19 US disclosed
US-8399444-B2 Bicyclic imidazole as DP1 receptor antagonists GlaxoSmithKline Intellectual Property Development Ltd. (GB) 2013-03-19 US disclosed
US-8399444-B2 Bicyclic imidazole as DP1 receptor antagonists GlaxoSmithKline Intellectual Property Development Ltd. (GB) 2013-03-19 US disclosed
EP-2373628-B1 Bicyclic imidazole derivatives GLAXO GROUP LTD (GB) 2013-01-16 EP disclosed
EP-2373628-A1 NOVEL COMPOUNDS Glaxo Group Limited (GB) 2011-10-12 EP disclosed
US-20110245310-A1 Novel Compounds GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2011-10-06 US disclosed
US-20110245310-A1 Novel Compounds GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2011-10-06 US disclosed
US-20110245310-A1 Novel Compounds GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2011-10-06 US disclosed
WO-2010070021-A1 NOVEL COMPOUNDS GLAXO GROUP LIMITED (GB) 2010-06-24 WO disclosed
WO-2010070021-A1 NOVEL COMPOUNDS GLAXO GROUP LIMITED (GB) 2010-06-24 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-20110245310-A1 Novel Compounds HRH1, CMA1, HRH4 CYP11B1 84/4885CYP11B2 88/4885MAPK1 2022/4885

“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.