SCHEMBL4101401

SCHEMBL4101401

O=C(Nn1ccc2cc(Cl)ccc21)Nn1ccc2cc(Cl)ccc21

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OXER1 Q8TDS5 2/20 0.46
CA12 O43570 1/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CA9 Q16790 1/20 0.42
HTR2A P28223 1/20 0.40
HTR2C P28335 1/20 0.40
RXFP1 Q9HBX9 1/20 0.39
KMO O15229 3/20 0.39
ROCK2 O75116 1/20 0.38
PIM1 P11309 1/20 0.38
PIM3 Q86V86 1/20 0.38
KRAS P01116 1/20 0.38
SLC6A2 P23975 1/20 0.36
SLC6A4 P31645 1/20 0.36
HDAC3 O15379 1/20 0.36
HDAC1 Q13547 1/20 0.36
HDAC2 Q92769 1/20 0.36
HDAC8 Q9BY41 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36

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
SCHEMBL27777662 0.87 OXER1 (0.43) OXER1CA12CA1CA2CA9
SCHEMBL28980321 0.87 OXER1 (0.43) OXER1CA12CA1CA2CA9
SCHEMBL4103818 0.85 KMT2A (0.50) OXER1CA12CA1CA2CA9
SCHEMBL4113201 0.83 KMT2A (0.52) SLC6A2
SCHEMBL8836401 0.83 OXER1 (0.44) OXER1CA12CA1CA2CA9
SCHEMBL4113322 0.82 BACE1 (0.44) OXER1RXFP1
SCHEMBL4101233 0.80 RAB9A (0.52) CA12CA1CA2CA9PIM1
SCHEMBL8836405 0.76 OXER1 (0.44) OXER1HTR2AHTR2CRXFP1KMO
SCHEMBL4108478 0.74 CA12 (0.52) CA12CA1CA2CA9SLC6A2
SCHEMBL3840185 0.73 THRB (0.42) RXFP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2078716-A1 New derivatives of 1H-indol-1-yl-urea, method for preparing same and pharmaceutical compositions containing them Les Laboratoires Servier (FR) 2009-07-15 EP disclosed
US-20090176794-A1 1H-INDOL-1-YL-UREA COMPOUNDS LES LABORATOIRES SERVIER (FR) 2009-07-09 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-20090176794-A1 1H-INDOL-1-YL-UREA COMPOUNDS TPH1, HTR1D, IDO1 OXER1 584/4885CA12 4648/4885CA1 3071/4885

“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.