SCHEMBL2922142

SCHEMBL2922142

Cc1cc[nH]c(=S)c1C#N

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HAVCR2 Q8TDQ0 1/20 0.50
ALDH1A1 P00352 9/20 0.41
HPGD P15428 6/20 0.41
APOBEC3G Q9HC16 4/20 0.41
GAA P10253 4/20 0.41
ALOX15 P16050 4/20 0.41
HSD17B10 Q99714 4/20 0.41
RXFP1 Q9HBX9 1/20 0.38
CYP1A2 P05177 1/20 0.35
CYP2C19 P33261 1/20 0.35
KDM4E B2RXH2 6/20 0.34
MAPT P10636 4/20 0.34
POLB P06746 2/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
RECQL P46063 2/20 0.33
TDP1 Q9NUW8 2/20 0.33
PPARG P37231 1/20 0.33
BLM P54132 1/20 0.33
MCL1 Q07820 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
SCHEMBL296497 0.75 KDM4E (0.45) ALDH1A1HPGDGAAHSD17B10CYP1A2
SCHEMBL5232417 0.71 KCNMA1 (0.35) HAVCR2ALDH1A1HPGDAPOBEC3GGAA
SCHEMBL19416818 0.69 ALDH1A1 (0.55) ALDH1A1HPGDGAAALOX15HSD17B10
SCHEMBL31050110 0.69 CYP1A2 (0.46) HAVCR2ALDH1A1HPGDAPOBEC3GGAA
SCHEMBL7975208 0.69 CYP1A2 (0.46) HAVCR2ALDH1A1HPGDAPOBEC3GGAA
SCHEMBL480061 0.69
SCHEMBL14722906 0.68 IMPDH2 (0.39) HAVCR2ALDH1A1HPGDAPOBEC3GALOX15
SCHEMBL18876109 0.68 TNF (0.40) HAVCR2ALDH1A1HPGDAPOBEC3GALOX15
SCHEMBL9820043 0.67 HAVCR2 (1.00) HAVCR2ALDH1A1HPGDAPOBEC3GGAA
SCHEMBL5231081 0.66 ALDH1A1 (0.47) ALDH1A1HPGDHSD17B10CYP1A2CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1940849-B1 ISOTHIAZOLOPYRIDIN-3-YLENAMINES FOR COMBATING ANIMAL PESTS BASF SE (DE) 2010-01-27 EP disclosed
EP-1915344-B1 CYANOPYRIDINE PESTICIDES BASF SE (DE) 2009-07-01 EP disclosed
US-20080227636-A1 Isothiazolopyridin-3-Ylenamines for Combating Animal Pests BASF SE (DE) 2008-09-18 US disclosed
US-20080207447-A1 Cyanopyridine Pesticides BASF AKTIENGESELLSCHAFT (DE) 2008-08-28 US disclosed
EP-1940849-A1 ISOTHIAZOLOPYRIDIN-3-YLENAMINES FOR COMBATING ANIMAL PESTS BASF SE (DE) 2008-07-09 EP disclosed
EP-1915344-A1 CYANOPYRIDINE PESTICIDES BASF SE (DE) 2008-04-30 EP disclosed
WO-2007045588-A1 ISOTHIAZOLOPYRIDIN-3-YLENAMINES FOR COMBATING ANIMAL PESTS BASF SE (DE) 2007-04-26 WO disclosed
WO-2007014913-A1 CYANOPYRIDINE PESTICIDES BASF AKTIENGESELLSCHAFT (DE) 2007-02-08 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 (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-20080227636-A1 Isothiazolopyridin-3-Ylenamines for Combating Animal Pests IPO5, PIR, ACHE HAVCR2 4631/4885ALDH1A1 2385/4885HPGD 4044/4885
US-20080207447-A1 Cyanopyridine Pesticides CBR3, CBR1, CHRM1 HAVCR2 3998/4885ALDH1A1 3463/4885HPGD 2378/4885

“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.