SCHEMBL3217680

SCHEMBL3217680

NC(=S)N(N)C1CCCc2ccccc21

nearest known ligand 0.61

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.49
HTT P42858 2/20 0.49
XBP1 P17861 1/20 0.49
TRPM8 Q7Z2W7 1/20 0.48
RAB9A P51151 1/20 0.47
IDO1 P14902 2/20 0.46
LMNA P02545 1/20 0.39
HTR1A P08908 1/20 0.39
ADRA2A P08913 1/20 0.39
ADRA1A P35348 1/20 0.39
OPRM1 P35372 1/20 0.39
CYP2D6 P10635 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
SCHEMBL3204426 0.90 TRPM8 (0.46) ALDH1A1HTTXBP1TRPM8IDO1
SCHEMBL10909572 0.81 IDO1 (0.53) ALDH1A1HTTXBP1TRPM8RAB9A
SCHEMBL16138349 0.79 ALDH1A1 (0.50) ALDH1A1HTTXBP1TRPM8RAB9A
SCHEMBL17577868 0.79 ALDH1A1 (0.50) ALDH1A1HTTXBP1TRPM8RAB9A
SCHEMBL3810645 0.76 ALDH1A1 (0.55) ALDH1A1HTTXBP1TRPM8RAB9A
SCHEMBL3151513 0.76 ALDH1A1 (0.57) ALDH1A1HTTXBP1TRPM8RAB9A
SCHEMBL11743947 0.75 ALDH1A1 (0.68) ALDH1A1HTTXBP1TRPM8RAB9A
SCHEMBL11710908 0.75 IDO1 (0.50) ALDH1A1HTTIDO1
SCHEMBL3053926 0.74 CHRNB2 (0.60) ALDH1A1HTTXBP1RAB9AIDO1
SCHEMBL12182299 0.74 CHRNB2 (0.60) ALDH1A1HTTXBP1RAB9AIDO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7674827-B2 Indanyl- and tetrahydronaphtyl-amino-thiourea compounds for combating animal pests BASF SE (DE) 2010-03-09 US claimed
US-20090075819-A1 Indanyl- and Tetrahydronaphtyl-amino-thiourea Compounds for Combating Animal Pests BASF SE (DE) 2009-03-19 US claimed
EP-1957447-A1 INDANYL-AND TETRAHYDRONAPHTYL-AMINO-THIOUREA COMPOUNDS FOR COMBATING ANIMAL PESTS BASF SE (DE) 2008-08-20 EP claimed
WO-2007060120-A1 INDANYL-AND TETRAHYDRONAPHTYL-AMINO-THIOUREA COMPOUNDS FOR COMBATING ANIMAL PESTS BASF SE (DE) 2007-05-31 WO claimed
EP-1957447-A1 INDANYL-AND TETRAHYDRONAPHTYL-AMINO-THIOUREA COMPOUNDS FOR COMBATING ANIMAL PESTS BASF SE (DE) 2008-08-20 EP disclosed
WO-2007060120-A1 INDANYL-AND TETRAHYDRONAPHTYL-AMINO-THIOUREA COMPOUNDS FOR COMBATING ANIMAL PESTS BASF SE (DE) 2007-05-31 WO 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-20090075819-A1 Indanyl- and Tetrahydronaphtyl-amino-thiourea Compounds for Combating Animal Pests AHCYL1, AHCY, TST ALDH1A1 2138/4885HTT 74/4885XBP1 3388/4885

“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.