SCHEMBL4807675

SCHEMBL4807675

CCCCCCNc1nc2c(s1)CCCC2C(=O)N(C)C1CCN(Cc2cc3ccccc3o2)C1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 2/20 0.40
LMNA P02545 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.36
OPRM1 P35372 1/20 0.34
OPRK1 P41145 1/20 0.34
FLT3 P36888 1/20 0.34
TYRO3 Q06418 1/20 0.34
MERTK Q12866 1/20 0.34
GAS6 Q14393 1/20 0.34
UTS2R Q9UKP6 1/20 0.34
HTR1A P08908 3/20 0.34
HTR2B P41595 3/20 0.34
DRD2 P14416 2/20 0.34
NPY5R Q15761 1/20 0.33
PDE2A O00408 1/20 0.33
HCRTR1 O43613 1/20 0.32
HCRTR2 O43614 1/20 0.32

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
SCHEMBL4801125 0.83 SMN1; SMN2 (0.39) MAPK1LMNASMN1; SMN2OPRM1OPRK1
SCHEMBL4801846 0.82 DRD2 (0.43) MAPK1LMNASMN1; SMN2HTR1AHTR2B
SCHEMBL4798494 0.74 RORC (0.40) MAPK1LMNASMN1; SMN2HTR1AHTR2B
SCHEMBL3157325 0.71 RORC (0.41) MAPK1LMNASMN1; SMN2HTR1AHTR2B
SCHEMBL3166173 0.69 ALDH1A1 (0.37) DRD2NPY5R
SCHEMBL4805873 0.69 CHRM4 (0.42) LMNASMN1; SMN2
SCHEMBL4805657 0.69 SMN1; SMN2 (0.43) LMNASMN1; SMN2TYRO3
SCHEMBL3260204 0.68 CLK2 (0.37) DRD2NPY5R
SCHEMBL4802914 0.68 KMT2A (0.38) LMNANPY5R
SCHEMBL4808373 0.68 HDAC1 (0.40) MAPK1SMN1; SMN2HTR2BDRD2

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-7348347-B2 Substituted 4,5,6,7-tetrahydrobenzthiazol-2-ylamine compounds GRUENENTHAL GMBH (DE) 2008-03-25 US disclosed
US-20070027315-A1 Substituted 4,5,6,7-tetrahydrobenzthiazol-2-ylamine compounds GRUENENTHAL GMBH (DE) 2007-02-01 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-20070027315-A1 Substituted 4,5,6,7-tetrahydrobenzthiazol-2-ylamine compounds TPH2, HTR6, TPH1 MAPK1 2330/4885LMNA 3504/4885SMN1; SMN2 1583/4885

“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.