SCHEMBL3947419

SCHEMBL3947419

CCCN1CCC(C(=O)Cl)CC1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.47
EPHX1 P07099 2/20 0.44
EPHX2 P34913 2/20 0.44
DRD2 P14416 3/20 0.43
KCNH2 Q12809 1/20 0.42
GNAI3 P08754 2/20 0.41
GNAO1 P09471 2/20 0.41
GNAI1 P63096 2/20 0.41
KDM2B Q8NHM5 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
UBE2M P61081 1/20 0.39
DCUN1D1 Q96GG9 1/20 0.39
ABL1 P00519 1/20 0.39
RIN1 Q13671 1/20 0.39

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
SCHEMBL28272527 0.83 SMN1; SMN2 (0.50) SMN1; SMN2EPHX1EPHX2DRD2KCNH2
SCHEMBL11750328 0.83 SMN1; SMN2 (0.64) SMN1; SMN2EPHX1EPHX2ABL1RIN1
SCHEMBL10697944 0.82 SMN1; SMN2 (0.49) SMN1; SMN2EPHX1EPHX2DRD2KCNH2
Hydrochloric Acid SCHEMBL6990148 0.82 SMN1; SMN2 (0.62) SMN1; SMN2EPHX1EPHX2GNAI3GNAO1
SCHEMBL458560 0.82 SMN1; SMN2 (0.61) SMN1; SMN2EPHX1EPHX2DRD2KCNH2
Hydrochloric Acid SCHEMBL5065549 0.80 SMN1; SMN2 (0.64) SMN1; SMN2EPHX1EPHX2DRD2KCNH2
SCHEMBL1438742 0.80 SMN1; SMN2 (0.71) SMN1; SMN2GNAI3GNAO1GNAI1L3MBTL1
Acetic Acid SCHEMBL8142720 0.78 SMN1; SMN2 (0.58) SMN1; SMN2EPHX1EPHX2KMT2AABL1
SCHEMBL14609068 0.78 KDM2B (0.61) SMN1; SMN2KDM2B
SCHEMBL19603150 0.77 BCHE (0.51) SMN1; SMN2EPHX1EPHX2DRD2KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090093474-A1 THIAZOLYL-DIHYDRO-INDAZOLE GRAUERT MATTHIAS 2009-04-09 US disclosed
US-20090093474-A1 THIAZOLYL-DIHYDRO-INDAZOLE GRAUERT MATTHIAS 2009-04-09 US disclosed
US-20090093474-A1 THIAZOLYL-DIHYDRO-INDAZOLE GRAUERT MATTHIAS 2009-04-09 US disclosed
EP-2018387-A1 THIAZOLYLDIHYDROINDAZOLES BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2009-01-28 EP disclosed
WO-2007115933-A1 THIAZOLYLDIHYDROINDAZOLES BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2007-10-18 WO disclosed
WO-2007115933-A1 THIAZOLYLDIHYDROINDAZOLES BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2007-10-18 WO disclosed
US-20070238718-A1 THIAZOLYL-DIHYDRO-INDAZOLE BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2007-10-11 US disclosed
US-20070238718-A1 THIAZOLYL-DIHYDRO-INDAZOLE BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2007-10-11 US disclosed
US-20070238718-A1 THIAZOLYL-DIHYDRO-INDAZOLE BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2007-10-11 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 (2 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-20090093474-A1 THIAZOLYL-DIHYDRO-INDAZOLE CYP3A43, CYP3A5, UGT1A3 SMN1; SMN2 3558/4885EPHX1 2775/4885EPHX2 2142/4885
US-20070238718-A1 THIAZOLYL-DIHYDRO-INDAZOLE CYP3A43, CYP3A5, UGT1A3 SMN1; SMN2 3558/4885EPHX1 2775/4885EPHX2 2142/4885

“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.