SCHEMBL6278599

SCHEMBL6278599

CC(CCOc1cc(C)cc(Oc2cc(C(F)(F)F)nn2C)n1)=C(F)F

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.39
ADORA2A P29274 1/20 0.39
ADORA1 P30542 1/20 0.39
ALDH1A1 P00352 1/20 0.39
TGFBR1 P36897 1/20 0.37
GPR119 Q8TDV5 1/20 0.33
PKM P14618 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
SCHEMBL6280190 0.90 KMT2A (0.40) KMT2AADORA2AADORA1ALDH1A1TGFBR1
SCHEMBL6281888 0.85 KMT2A (0.39) KMT2AADORA2AADORA1ALDH1A1TGFBR1
SCHEMBL6612122 0.83 KMT2A (0.41) KMT2AADORA2AADORA1ALDH1A1TGFBR1
SCHEMBL6280223 0.82 ADORA2A (0.50) KMT2AADORA2AADORA1ALDH1A1TGFBR1
SCHEMBL6609351 0.82 ADORA2A (0.41) KMT2AADORA2AADORA1ALDH1A1TGFBR1
SCHEMBL8315159 0.81 KMT2A (0.41) KMT2AADORA2AADORA1ALDH1A1TGFBR1
SCHEMBL6276965 0.80 KMT2A (0.40) KMT2AADORA2AADORA1ALDH1A1TGFBR1
SCHEMBL6284577 0.78 KMT2A (0.43) KMT2AADORA2AADORA1ALDH1A1TGFBR1
SCHEMBL5781569 0.77 ADORA2A (0.47) KMT2AADORA2AADORA1ALDH1A1TGFBR1
SCHEMBL6280230 0.77 KMT2A (0.41) KMT2AADORA2AADORA1ALDH1A1TGFBR1

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
US-20020198381-A1 Herbicidal pyridine compounds INTELLECTUAL PROPERTY DEPARTMENT BASF AKTIENGESELLSCHAFT (DE) 2002-12-26 US claimed
US-6130188-A Herbicidal pyridine compounds AMERICAN CYANAMID COMPANY (US) 2000-10-10 US claimed
EP-0955300-A2 Herbicidal pyridine compounds American Cyanamid Company (US) 1999-11-10 EP claimed
US-6852673-B2 Herbicidal pyridine compounds BASF AKTIENGESELLSCHAFT (DE) 2005-02-08 US disclosed
US-20020198381-A1 Herbicidal pyridine compounds INTELLECTUAL PROPERTY DEPARTMENT BASF AKTIENGESELLSCHAFT (DE) 2002-12-26 US disclosed
US-6420315-B1 5-THIEN-3-YL-2-OXY- OR -2-THIO-PYRIDINES; HIGH SELECTIVITY FOR BROADLEAF AND GRASSY WEEDS IN CROPS, SUCH AS MAIZE AND RICE; PRE- AND POST-EMERGENCE BASF AKTIENGESELLSCHAFT (DE) 2002-07-16 US disclosed
US-6130188-A Herbicidal pyridine compounds AMERICAN CYANAMID COMPANY (US) 2000-10-10 US disclosed
EP-0955300-A2 Herbicidal pyridine compounds American Cyanamid Company (US) 1999-11-10 EP 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-20020198381-A1 Herbicidal pyridine compounds HAX1, CYP4X1, PRDX1 KMT2A 835/4885ADORA2A 1742/4885ADORA1 365/4885

“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.