SCHEMBL10167672

SCHEMBL10167672

CCCC(=O)N(CC)c1nsc2cccc(OC(F)F)c12

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCRTR1 O43613 5/20 0.35
HCRTR2 O43614 5/20 0.35
PDE4A P27815 2/20 0.34
PDE4B Q07343 2/20 0.34
PDE4C Q08493 2/20 0.34
PDE4D Q08499 2/20 0.34
TP53 P04637 2/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
TSHR P16473 1/20 0.33
RAB9A P51151 1/20 0.32
CRHR1 P34998 1/20 0.32
LIPG Q9Y5X9 1/20 0.32
LMNA P02545 2/20 0.31
KDM4E B2RXH2 1/20 0.31
MAPT P10636 1/20 0.31
HTT P42858 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
THRB P10828 1/20 0.31
MAPK1 P28482 1/20 0.30

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
SCHEMBL10167494 0.91 HCRTR1 (0.36) HCRTR1HCRTR2MEN1KMT2ATSHR
SCHEMBL352205 0.88 HCRTR1 (0.34) HCRTR1HCRTR2PDE4BMEN1KMT2A
SCHEMBL351412 0.88 PDE4A (0.34) HCRTR1HCRTR2PDE4APDE4BPDE4C
SCHEMBL10167489 0.88 HCRTR1 (0.38) HCRTR1HCRTR2PDE4BTP53MEN1
SCHEMBL10167516 0.86 KCNA5 (0.41) TP53MEN1KMT2ATSHRKDM4E
SCHEMBL291192 0.85 HCRTR1 (0.37) HCRTR1HCRTR2MEN1KMT2ATSHR
SCHEMBL10167495 0.84 MEN1 (0.41) HCRTR1HCRTR2MEN1KMT2ATSHR
SCHEMBL10167492 0.83 MAPT (0.36) HCRTR1HCRTR2PDE4BTP53LMNA
SCHEMBL10167484 0.81 HCRTR1 (0.35) HCRTR1HCRTR2PDE4BMEN1KMT2A
SCHEMBL13903694 0.80 KDM4E (0.34) HCRTR1HCRTR2CRHR1LMNAKDM4E

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-8119568-B2 3-amino-1,2-benzisothiazole compounds for combating animal pest II BASF SE (DE) 2012-02-21 US disclosed
US-8119568-B2 3-amino-1,2-benzisothiazole compounds for combating animal pest II BASF SE (DE) 2012-02-21 US disclosed
US-20100009848-A1 3-Amino-1,2-Benzisothiazole Compounds for Combating Animal Pest II BASF SE (DE) 2010-01-14 US disclosed
US-20100009848-A1 3-Amino-1,2-Benzisothiazole Compounds for Combating Animal Pest II BASF SE (DE) 2010-01-14 US disclosed
WO-2008090048-A2 3-AMINO-1,2-BENZISOTHIAZOLE COMPOUNDS FOR COMBATING ANIMAL PEST II BASF SE (DE) 2008-07-31 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-20100009848-A1 3-Amino-1,2-Benzisothiazole Compounds for Combating Animal Pest II BPNT1, BCAT1, TGFBR1 HCRTR1 1004/4885HCRTR2 2047/4885PDE4A 3137/4885

“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.