SCHEMBL10167640

SCHEMBL10167640

O=C(Nc1nsc2cccc(Cl)c12)c1cnccc1C(F)(F)F

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.47
POLB P06746 1/20 0.47
ALDH1A1 P00352 1/20 0.46
TYK2 P29597 4/20 0.43
ROCK2 O75116 1/20 0.38
ROCK1 Q13464 1/20 0.38
DGAT2 Q96PD7 1/20 0.37
JAK2 O60674 4/20 0.37
JAK1 P23458 2/20 0.36
CYP3A4 P08684 1/20 0.36
CYP11B2 P19099 1/20 0.36
BRAF P15056 1/20 0.36
KDR P35968 1/20 0.36
KDM4E B2RXH2 1/20 0.36
MALT1 Q9UDY8 1/20 0.36
MAPT P10636 1/20 0.36
CSF1R P07333 1/20 0.36
GRM4 Q14833 1/20 0.35
P2RX7 Q99572 1/20 0.35
LMNA P02545 1/20 0.35

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
SCHEMBL10167638 0.85 MAPT (0.49) NPC1POLBALDH1A1DGAT2JAK2
SCHEMBL10167617 0.83 SCN9A (0.41) NPC1POLBALDH1A1DGAT2MAPT
SCHEMBL10167652 0.78 MAPT (0.46) NPC1POLBALDH1A1TYK2MAPT
SCHEMBL10167667 0.77 SMO (0.44) LMNA
SCHEMBL10167657 0.76 LMNA (0.51) LMNA
SCHEMBL10167653 0.75 TRPV1 (0.42) P2RX7
SCHEMBL351264 0.75 MAPT (0.43) NPC1POLBALDH1A1TYK2KDM4E
SCHEMBL4380910 0.72 MAPK1 (0.43) ALDH1A1ROCK2ROCK1KDRKDM4E
SCHEMBL10167644 0.71 KMT2A (0.48) NPC1POLBALDH1A1KDRKDM4E
SCHEMBL1203559 0.70 NPC1 (0.55) NPC1POLBALDH1A1TYK2ROCK2

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 4 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

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 NPC1 2906/4885POLB 4431/4885ALDH1A1 452/4885

“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.