SCHEMBL4240199

SCHEMBL4240199

Cc1cc(-n2cc(C(=O)NC(=N)N)c3ccccc32)c2ccccc2n1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.43
NCF1 P14598 3/20 0.42
PIK3R2 O00459 1/20 0.42
ADRB2 P07550 1/20 0.40
ADRB1 P08588 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
LMNA P02545 1/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
RAB9A P51151 2/20 0.39
RORC P51449 1/20 0.39
NPC1 O15118 1/20 0.39
NR4A2 P43354 1/20 0.39
USP2 O75604 1/20 0.38
GAA P10253 1/20 0.38
HTT P42858 1/20 0.38
KDM4E B2RXH2 1/20 0.38
ALDH1A1 P00352 1/20 0.38

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
Trifluoroacetic Acid SCHEMBL4243180 0.94 PIK3R2 (0.41) L3MBTL1NCF1PIK3R2ADRB2ADRB1
SCHEMBL4244687 0.90 GAA (0.38) L3MBTL1NCF1PIK3R2SMN1; SMN2LMNA
SCHEMBL4239462 0.90 GAA (0.44) L3MBTL1RORCGAAKDM4EALDH1A1
SCHEMBL4060598 0.87 SMN1; SMN2 (0.42) L3MBTL1NCF1PIK3R2ADRB2ADRB1
Hydrochloric Acid SCHEMBL4063788 0.86 SMN1; SMN2 (0.42) L3MBTL1NCF1PIK3R2ADRB2ADRB1
SCHEMBL4243769 0.85 CD38 (0.40) MEN1KMT2ARORCALDH1A1
SCHEMBL4245433 0.85 ADRB2 (0.43) ADRB2SMN1; SMN2LMNAMEN1KMT2A
SCHEMBL4243183 0.84 PIK3R2 (0.37) L3MBTL1NCF1PIK3R2SMN1; SMN2LMNA
Hydrochloric Acid SCHEMBL4240234 0.84 ADRB2 (0.43) ADRB2SMN1; SMN2LMNAMEN1KMT2A
SCHEMBL6083689 0.82 L3MBTL1 (0.44) L3MBTL1NCF1PIK3R2ADRB2ADRB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040214820-A1 3-guanidinocarbonyl-1-heteroaryl-indole derivatives, preparation process, their use as medicaments, and pharmaceutical compositions comprising them AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2004-10-28 US claimed
US-7638521-B2 3-guanidinocarbonyl-1-heteroaryl-indole derivatives, preparation process, their use as medicaments, and pharmaceutical compositions comprising them SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2009-12-29 US disclosed
US-20040214820-A1 3-guanidinocarbonyl-1-heteroaryl-indole derivatives, preparation process, their use as medicaments, and pharmaceutical compositions comprising them AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2004-10-28 US 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-20040214820-A1 3-guanidinocarbonyl-1-heteroaryl-indole derivatives, preparation process, their use as medicaments, and pharmaceutical compositions comprising them IDO1, IDO2, HTR3C L3MBTL1 4827/4885NCF1 3098/4885PIK3R2 2322/4885

“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.