Sugi Predict

Sugi Predict / Compounds / SCHEMBL1041093

SCHEMBL1041093

SCHEMBL1041093

Cc1cc(C)cc(CC(NC2=NCCS2)c2cccc3c2CCCC3)c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 7/20 0.37
▸ NPC1 O15118 6/20 0.37
▸ KDM4E B2RXH2 2/20 0.37
▸ LMNA P02545 3/20 0.36
▸ TAAR1 Q96RJ0 1/20 0.36
▸ SMN1; SMN2 Q16637 6/20 0.36
▸ CYP3A4 P08684 1/20 0.34
▸ CYP2D6 P10635 1/20 0.34
▸ TSHR P16473 1/20 0.34
▸ L3MBTL1 Q9Y468 2/20 0.34
▸ MAPT P10636 1/20 0.33
▸ BLM P54132 1/20 0.33
▸ PMP22 Q01453 1/20 0.33
▸ ATM Q13315 2/20 0.33
▸ ALDH1A1 P00352 2/20 0.32
▸ GAA P10253 2/20 0.32
▸ NFKB1 P19838 1/20 0.32
▸ NFKB2 Q00653 1/20 0.32
▸ RELA Q04206 1/20 0.32
▸ NPY1R P25929 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
SCHEMBL12264052 0.98 RAB9A (0.37) RAB9ANPC1KDM4ELMNATAAR1
SCHEMBL12264051 0.87 RAB9A (0.36) RAB9ANPC1KDM4ELMNATAAR1
SCHEMBL12264044 0.84 SMN1; SMN2 (0.36) RAB9ANPC1KDM4ELMNATAAR1
SCHEMBL229249 0.84 RAB9A (0.40) RAB9ANPC1KDM4ELMNATAAR1
SCHEMBL12264054 0.82 NPC1 (0.38) RAB9ANPC1KDM4ELMNATAAR1
SCHEMBL12264053 0.82 NPC1 (0.36) RAB9ANPC1KDM4ELMNATAAR1
SCHEMBL1096470 0.80 ATM (0.41) RAB9ANPC1KDM4ELMNATAAR1
SCHEMBL12264045 0.80 HSD17B10 (0.45) RAB9ANPC1KDM4ELMNATAAR1
SCHEMBL12264042 0.79 NPC1 (0.35) RAB9ANPC1KDM4ELMNATAAR1
SCHEMBL12264048 0.78 NPC1 (0.40) RAB9ANPC1KDM4ELMNATAAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8580710-B2 Pesticidal active mixtures comprising aminothiazoline compounds BASF SE (DE) 2013-11-12 — — US disclosed
US-8580710-B2 Pesticidal active mixtures comprising aminothiazoline compounds BASF SE (DE) 2013-11-12 — — US disclosed
US-8580710-B2 Pesticidal active mixtures comprising aminothiazoline compounds BASF SE (DE) 2013-11-12 — — US disclosed
US-20110224075-A1 Pesticidal Active Mixtures Comprising Aminothiazoline Compounds BASF SE (DE) 2011-09-15 — — US disclosed
US-20110224075-A1 Pesticidal Active Mixtures Comprising Aminothiazoline Compounds BASF SE (DE) 2011-09-15 — — US disclosed
US-20110224075-A1 Pesticidal Active Mixtures Comprising Aminothiazoline Compounds BASF SE (DE) 2011-09-15 — — US disclosed
EP-2273883-A2 PESTICIDAL ACTIVE MIXTURES COMPRISING AMINOTHIAZOLINE COMPOUNDS BASF SE (DE) 2011-01-19 — — EP disclosed
WO-2009118297-A2 PESTICIDAL ACTIVE MIXTURES COMPRISING AMINOTHIAZOLINE COMPOUNDS BASF SE (DE) 2009-10-01 — — WO disclosed
WO-2009118297-A2 PESTICIDAL ACTIVE MIXTURES COMPRISING AMINOTHIAZOLINE COMPOUNDS BASF SE (DE) 2009-10-01 — — 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-20110224075-A1 Pesticidal Active Mixtures Comprising Aminothiazoline Compounds CBR3, AOC3, MT-CO3 RAB9A 2260/4885NPC1 2841/4885KDM4E 4003/4885

“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.