SCHEMBL633788

SCHEMBL633788

Cc1c(F)c(O)cc2cc(Br)cnc12

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.44
PRNP P04156 1/20 0.44
HPGD P15428 1/20 0.44
HTT P42858 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
NOD2 Q9HC29 1/20 0.44
KDM4E B2RXH2 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
DYRK1A Q13627 1/20 0.30

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
SCHEMBL633429 0.79 ALDH1A1 (0.47) PRNPNPSR1SMN1; SMN2
SCHEMBL27908746 0.72 CCR1 (0.42) HTTNPSR1KDM4ESMN1; SMN2DYRK1A
SCHEMBL30059116 0.72 HTT (0.41) LMNAPRNPHPGDHTTNPSR1
SCHEMBL21403775 0.72 HTT (0.41) LMNAPRNPHPGDHTTNPSR1
SCHEMBL534655 0.70 HTT (0.40) LMNAPRNPHPGDHTTNPSR1
SCHEMBL1927586 0.70 ESR1 (0.33) LMNAPRNPHPGDHTTNPSR1
SCHEMBL19783063 0.68 NSD1 (0.37) LMNAPRNPHPGDHTTNPSR1
SCHEMBL21989013 0.67 DYRK1A (0.35) HPGDHTTNPSR1KDM4ESMN1; SMN2
SCHEMBL23905532 0.67 KDM4E (0.56) LMNAPRNPHPGDHTTNPSR1
SCHEMBL20176008 0.67 LMNA (0.40) LMNAPRNPHPGDHTTNPSR1

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
CN-103183637-A Quinoline derivatives and use thereof as fungicides SYNGENTA CROP PROT INC 2013-07-03 CN disclosed
US-8415272-B2 Quinoline derivatives and their use as fungicides SYNGENTA CROP PROTECTION LLC (US) 2013-04-09 US disclosed
CN-101910135-B Quinoline derivatives and their use as fungicides SYNGENTA PARTICIPATIONS AG 2013-03-13 CN disclosed
EP-2231614-B1 Quinoline derivatives and their use as fungicides SYNGENTA PARTICIPATIONS AG (CH) 2012-02-22 EP disclosed
CN-101910135-A Quinoline derivatives and their use as fungicides SYNGENTA PARTICIPATIONS AG 2010-12-08 CN disclosed
US-20100280068-A1 QUINOLINE DERIVATIVES AND THEIR USE AS FUNGICIDES SYNGENTA CROP PROTECTION, INC. (US) 2010-11-04 US disclosed
EP-2231614-A2 QUINOLINE DERIVATIVES AND THEIR USE AS FUNGICIDES Syngenta Participations AG (CH) 2010-09-29 EP disclosed
WO-2009087098-A2 QUINOLINE DERIVATIVES AND THEIR USE AS FUNGICIDES SYNGENTA PARTICIPATIONS AG (CH) 2009-07-16 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-20100280068-A1 QUINOLINE DERIVATIVES AND THEIR USE AS FUNGICIDES CYP1A1, CYP3A7, CYP1A2 LMNA 4023/4885PRNP 3769/4885HPGD 3732/4885

“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.