SCHEMBL2903364

SCHEMBL2903364

Clc1ncccc1-c1n[c]cs1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 7/20 0.36
RAB9A P51151 7/20 0.36
MAPT P10636 4/20 0.36
PKM P14618 1/20 0.36
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
MPI P34949 1/20 0.34
SMN1; SMN2 Q16637 2/20 0.33
LMNA P02545 2/20 0.33
CYP19A1 P11511 1/20 0.33
NFKB1 P19838 1/20 0.33
CASP3 P42574 1/20 0.33
NFKB2 Q00653 1/20 0.33
RELA Q04206 1/20 0.33
SENP7 Q9BQF6 1/20 0.33
SENP6 Q9GZR1 1/20 0.33
C1S P09871 1/20 0.33
POLB P06746 1/20 0.33
MAPK1 P28482 1/20 0.33
S100A4 P26447 1/20 0.33

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
SCHEMBL2897580 0.74
SCHEMBL2752330 0.74 HTR2C (0.39) MAPK1
SCHEMBL2900102 0.71 CYP19A1 (0.36) CYP19A1
SCHEMBL2897723 0.70 NPC1 (0.40) NPC1RAB9AMAPTPKMMEN1
SCHEMBL1428366 0.69 KDM4E (0.52) NPC1RAB9AMAPTPKMSMN1; SMN2
SCHEMBL27761013 0.68 NPC1 (0.50) NPC1RAB9AMAPTPKMMEN1
SCHEMBL2753759 0.67 TRPM8 (0.31) SMN1; SMN2LMNACYP1A2
SCHEMBL2752772 0.67 ALDH1A1 (0.40) RAB9AMAPTPKMKDM4EGAA
SCHEMBL2900498 0.66
SCHEMBL2902960 0.66 TRPV1 (0.36)

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
US-20100305124-A1 Acylated Aminopyridine and Aminopyridazine Insecticides BAYER CROPSCIENCE AG (DE) 2010-12-02 US disclosed
EP-2236505-A1 Acylated aminopyridines and pyridazines as insecticides Bayer CropScience AG (DE) 2010-10-06 EP 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-20100305124-A1 Acylated Aminopyridine and Aminopyridazine Insecticides AAAS, DDT, QDPR NPC1 4631/4885RAB9A 1806/4885MAPT 3480/4885

“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.