SCHEMBL3214905

SCHEMBL3214905

Cc1cc2ncc(Br)cc2cc1O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 3/20 0.40
HTT P42858 3/20 0.40
HPGD P15428 3/20 0.40
LMNA P02545 1/20 0.40
PRNP P04156 1/20 0.40
NOD2 Q9HC29 1/20 0.40
PDGFRB P09619 3/20 0.38
EGFR P00533 2/20 0.38
PDGFRA P16234 2/20 0.38
ALDH1A1 P00352 5/20 0.36
SMN1; SMN2 Q16637 3/20 0.36
MAPT P10636 4/20 0.35
KDM4E B2RXH2 3/20 0.35
DYRK1A Q13627 2/20 0.35
MAPK1 P28482 2/20 0.35
ALOX12 P18054 2/20 0.34
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2D6 P10635 1/20 0.34
G6PD P11413 1/20 0.34

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
SCHEMBL3217581 0.78 PDGFRB (0.38) NPSR1HTTHPGDLMNAPRNP
SCHEMBL23429990 0.78 ALDH1A1 (0.36) NPSR1HTTPDGFRBPDGFRAALDH1A1
SCHEMBL3222941 0.78 PLAU (0.39) NPSR1HTTHPGDLMNAPRNP
SCHEMBL18571995 0.74 PDGFRB (0.38) HTTPDGFRBEGFRPDGFRADYRK1A
SCHEMBL18571804 0.74 PLAU (0.39) HTTHPGDPDGFRBEGFRPDGFRA
SCHEMBL16537787 0.74 PDGFRB (0.48) PDGFRBPDGFRA
SCHEMBL24637975 0.73 CYP1A2 (0.47) NPSR1HPGDPDGFRBEGFRPDGFRA
SCHEMBL3892773 0.72 EGFR (0.43) NPSR1HPGDPDGFRBEGFRPDGFRA
SCHEMBL18318734 0.71 PDGFRB (0.51) NPSR1PRNPPDGFRBPDGFRAALDH1A1
SCHEMBL6288436 0.71 DYRK1A (0.38) NPSR1HTTPDGFRBEGFRPDGFRA

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
CN-101522030-B Fungicides SYNGENTA PARTICIPATIONS AG 2012-09-05 CN disclosed
US-20100056570-A1 FUNGICIDES SYNGENTA CROP PROTECTION, INC. (US) 2010-03-04 US disclosed
CN-101522030-A Fungicides SYNGENTA PARTICIPATIONS AG (CH) 2009-09-02 CN disclosed
EP-2068632-A1 FUNGICIDES Syngeta Participations AG (CH) 2009-06-17 EP disclosed
WO-2008028624-A1 FUNGICIDES SYNGENTA PARTICIPATIONS AG (CH) 2008-03-13 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-20100056570-A1 FUNGICIDES CYP21A2, CYP51A1, CYP4X1 NPSR1 3200/4885HTT 3521/4885HPGD 3810/4885

“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.