SCHEMBL4593568

SCHEMBL4593568

C#CCOc1cc(N=C=S)c(F)cc1Cl

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.41
PGK1 P00558 1/20 0.39
HPGD P15428 2/20 0.35
TSHR P16473 1/20 0.35
NR1I2 O75469 1/20 0.33
ADRA2A P08913 1/20 0.33
ADORA3 P0DMS8 1/20 0.33
ADRA2B P18089 1/20 0.33
ADRA2C P18825 1/20 0.33
TACR2 P21452 1/20 0.33
DRD1 P21728 1/20 0.33
SLC6A2 P23975 1/20 0.33
HTR2A P28223 1/20 0.33
HTR2C P28335 1/20 0.33
ADORA1 P30542 1/20 0.33
SLC6A4 P31645 1/20 0.33
OPRM1 P35372 1/20 0.33
DRD3 P35462 1/20 0.33
OPRK1 P41145 1/20 0.33
HTR6 P50406 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
SCHEMBL7081041 0.86 LMNA (0.41) LMNAPGK1HPGDTSHRNR1I2
SCHEMBL8603005 0.84 NR1I2 (0.39) NR1I2ADRA2AADORA3ADRA2BADRA2C
SCHEMBL8602412 0.82 PPOX (0.38) LMNAHTR2CSMN1; SMN2
SCHEMBL8600619 0.80 SMN1; SMN2 (0.42) HPGDTSHRHTTSMN1; SMN2
SCHEMBL8599225 0.80 PPOX (0.40) HPGDHTTSMN1; SMN2
SCHEMBL8601595 0.79 PPOX (0.41) TSHRADRA2AADRA2BADRA2CHTR2A
SCHEMBL8603600 0.78 TDP1 (0.46) HPGDTSHRHTT
SCHEMBL8603664 0.78 SMN1; SMN2 (0.40) HPGDTSHRHTTEGFRSMN1; SMN2
SCHEMBL7535311 0.77 NPC1 (0.38) LMNAHPGDHTR2ASLC6A4KCNH2
SCHEMBL8982274 0.77 LMNA (0.41) LMNAPGK1HPGDTSHRNR1I2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8212050-B2 Amidine compounds and herbicides NIPPON SODA CO., LTD. (JP) 2012-07-03 US disclosed
US-20110301355-A1 Amidine compounds and herbicides NIPPON SODA CO., LTD. (JP) 2011-12-08 US disclosed
EP-1911350-A1 AMIDINE COMPOUND AND HERBICIDE NIPPON SODA CO., LTD. (JP) 2008-04-16 EP disclosed
EP-0626370-B1 Process for producing aromatic isothiocyanate derivatives SUMITOMO CHEMICAL CO (JP) 1998-02-11 EP disclosed
EP-0626370-A1 Process for producing aromatic isothiocyanate derivatives SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1994-11-30 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-20110301355-A1 Amidine compounds and herbicides DDT, GATD3, PAM LMNA 1418/4885PGK1 2389/4885HPGD 533/4885

“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.