SCHEMBL4101233

SCHEMBL4101233

O=C(Nc1ccccn1)Nn1ccc2cc(Cl)ccc21

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 7/20 0.52
NPC1 O15118 6/20 0.52
GRIK1 P39086 1/20 0.51
KCNMA1 Q12791 1/20 0.48
KMT2A Q03164 4/20 0.46
MEN1 O00255 3/20 0.46
SMARCA2 P51531 1/20 0.46
SMARCA4 P51532 1/20 0.46
PKM P14618 3/20 0.45
MITF O75030 1/20 0.45
TP53 P04637 1/20 0.45
HPGD P15428 1/20 0.45
XBP1 P17861 1/20 0.45
SMN1; SMN2 Q16637 2/20 0.44
S1PR1 P21453 1/20 0.44
S1PR3 Q99500 1/20 0.44
CNR2 P34972 1/20 0.44
ADORA3 P0DMS8 1/20 0.44
PIM1 P11309 1/20 0.44
ADORA2A P29274 1/20 0.44

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
SCHEMBL4108710 0.85 RAB9A (0.50) RAB9ANPC1KMT2AMEN1PKM
SCHEMBL4103818 0.81 KMT2A (0.50) RAB9ANPC1GRIK1KMT2AMEN1
SCHEMBL4101401 0.80 OXER1 (0.46) PIM1PIM3CA12CA1CA2
SCHEMBL4113201 0.79 KMT2A (0.52) GRIK1KCNMA1KMT2AMEN1SMARCA2
SCHEMBL4113322 0.73 BACE1 (0.44) KMT2AMEN1TP53HPGDLMNA
SCHEMBL28980321 0.72 OXER1 (0.43) RAB9AKMT2AHPGDPIM1PIM3
SCHEMBL27777662 0.72 OXER1 (0.43) NPC1PIM1PIM3CA12CA1
SCHEMBL28614456 0.70 CA12 (0.54) RAB9ANPC1KMT2AMEN1SMN1; SMN2
SCHEMBL9400613 0.70 HTR2B (0.65) RAB9ANPC1KMT2AMEN1SMARCA2
SCHEMBL4107498 0.69 CA12 (0.50) RAB9AKMT2ASMN1; SMN2CA12CA1

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 RAB9A 1050/4885NPC1 2553/4885GRIK1 337/4885

“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.