SCHEMBL5229917

SCHEMBL5229917

CC(C)(C)n1nccc1O

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
DRD1 P21728 1/20 0.31

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
SCHEMBL5579260 0.76
SCHEMBL2930358 0.73 ALDH1A1 (0.35) DRD1
SCHEMBL13735835 0.71 DRD1 (0.31) DRD1
SCHEMBL20843895 0.71 DRD1 (0.31) DRD1
SCHEMBL17846276 0.71 PDE10A (0.32) DRD1
SCHEMBL6762492 0.71 DRD1 (0.31) DRD1
SCHEMBL402261 0.71 SMN1; SMN2 (0.39) DRD1
SCHEMBL21719883 0.70 DRD1 (0.33) DRD1
SCHEMBL18235314 0.68 DRD1 (0.30) DRD1
SCHEMBL333295 0.67

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070197393-A1 TRICYCLIC BENZOYLPYRAZOLE DERIVATIVES WITSCHEL MATTHIAS 2007-08-23 US disclosed
EP-1163240-B1 TRICYCLIC BENZOYLPYRAZOLE DERIVATIVES USED AS A HERBICIDE BASF AG (DE) 2007-03-14 EP disclosed
US-7115545-B1 Tricyclic benzoylpyrazole derivatives used as a herbicide BASF AKTIENGESELLSCHAFT (DE) 2006-10-03 US disclosed
US-6831039-B1 Herbicides with high crop plants compatibility BASF AKTIENGESELLSCHAFT (DE) 2004-12-14 US disclosed
EP-1135388-B1 3-(HETEROCYCLYL)-SUBSTITUTED BENZOYLPYRAZOLS BASF AG (DE) 2003-09-10 EP disclosed
US-6506708-B1 Herbicidal activity of the 3-(heterocyclyl)benzoylpyrazole derivatives of the formula I was demonstrated BASF AKTIENGESELLSCHAFT (DE) 2003-01-14 US disclosed
EP-1135387-B1 3-(HETEROCYCLYL)-BENZOYLPYRAZOLE-DERIVATIVES BASF AG (DE) 2002-11-06 EP disclosed
CN-1332738-A 3- (heterocyclyl) -substituted benzoylpyrazoles BASF AG (DE) 2002-01-23 CN disclosed
EP-1163240-A1 TRICYCLIC BENZOYLPYRAZOLE DERIVATIVES USED AS A HERBICIDE BASF AKTIENGESELLSCHAFT (DE) 2001-12-19 EP disclosed
EP-1135387-A2 3-(HETEROCYCLYL)-BENZOYLPYRAZOLE-DERIVATIVES BASF AKTIENGESELLSCHAFT (DE) 2001-09-26 EP disclosed
EP-1135388-A2 3-(HETEROCYCLYL)-SUBSTITUTED BENZOYLPYRAZOLS BASF AKTIENGESELLSCHAFT (DE) 2001-09-26 EP disclosed
US-6265606-B1 TO CONTROL A BROAD SPECTRUM OF UNDESIRABLE VEGETATION, ARE SELECTIVE TO MAJOR CROPS, HAVE DESIRABLE ENVIRONMENTAL PROFILES, DOW AGROSCIENCES LLC 2001-07-24 US disclosed
WO-2000055158-A1 TRICYCLIC BENZOYLPYRAZOLE DERIVATIVES USED AS A HERBICIDE BASF AKTIENGESELLSCHAFT (DE) 2000-09-21 WO disclosed
WO-2000034272-A2 3-(HETEROCYCLYL)-BENZOYLPYRAZOLE-DERIVATIVES BASF AKTIENGESELLSCHAFT (DE) 2000-06-15 WO disclosed
WO-2000034273-A2 3-(HETEROCYCLYL)-SUBSTITUTED BENZOYLPYRAZOLS BASF AKTIENGESELLSCHAFT (DE) 2000-06-15 WO disclosed
US-6010981-A 1-alkyl-4-benzoyl-5-hydroxypyrazole compounds and their use as herbicides DOW AGROSCIENCES LLC (US) 2000-01-04 US disclosed
US-5962690-A HERBICIDES DOW AGROSCIENCES LLC (US) 1999-10-05 US disclosed
EP-0914317-A2 1-ALKYL-4-BENZOYL-5-HYDROXYPYRAZOLE COMPOUNDS AND THEIR USE AS HERBICIDES Dow AgroSciences LLC (US) 1999-05-12 EP disclosed
WO-1998052926-A2 1-ALKYL-4-BENZOYL-5-HYDROXYPYRAZOLE COMPOUNDS AND THEIR USE AS HERBICIDES DOW AGROSCIENCES LLC (US) 1998-11-26 WO disclosed
US-5824802-A POSTEMERGENT HERBICIDE FOR CORN, WHEAT, BARLEY, RICE DOW AGROSCIENCES LLC (US) 1998-10-20 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-20070197393-A1 TRICYCLIC BENZOYLPYRAZOLE DERIVATIVES CBR3, CBR1, KAT8 DRD1 632/4885

“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.