SCHEMBL3866828

SCHEMBL3866828

NC(=O)c1cnc2ccc(F)cc2c1Cl

nearest known ligand 0.46

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CSF1R P07333 8/20 0.46
JAK2 O60674 6/20 0.43
HTR5A P47898 1/20 0.43
PDE4B Q07343 1/20 0.42
LMNA P02545 1/20 0.42
MAP4K4 O95819 1/20 0.42
JAK3 P52333 1/20 0.41
SLC2A1 P11166 1/20 0.40
CD38 P28907 1/20 0.40

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
SCHEMBL18318006 0.88 CSF1R (0.49) CSF1RJAK2MAP4K4SLC2A1
SCHEMBL7496024 0.86 DHODH (0.46) LMNA
SCHEMBL2718101 0.85 TSHR (0.43) CSF1RLMNA
SCHEMBL9875438 0.84 LMNA (0.56) CSF1RPDE4BLMNASLC2A1
SCHEMBL2479384 0.82 LMNA (0.42) CSF1RPDE4BLMNASLC2A1CD38
SCHEMBL2725311 0.82 HTT (0.49) CSF1RPDE4BLMNASLC2A1
SCHEMBL4627675 0.81 SLC2A1 (0.48) CSF1RPDE4BLMNASLC2A1
SCHEMBL5929785 0.79 NNMT (0.46) CSF1RLMNASLC2A1
SCHEMBL4657732 0.78 PDE4B (0.49) PDE4B
SCHEMBL3273151 0.78 KDM4E (0.64) CSF1RPDE4BLMNA

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
EP-1687276-B1 NOVEL METHOD OF PREPARING 3-FLUORINATED QUINOLINES NOVEXEL (FR) 2009-10-14 EP disclosed
US-7396934-B2 Process for preparing 3-fluoroquinolines NOVEXEL (FR) 2008-07-08 US disclosed
EP-1687276-A1 NOVEL METHOD OF PREPARING 3-FLUORINATED QUINOLINES NOVEXEL (FR) 2006-08-09 EP disclosed
US-20050182259-A1 Subjecting a substituted quinoline-3-carboxamide compound to Hofmann degradation to obtain amine derivative, forming diazonium salt by reacting amine derivative with borontrifluoride-ethyl ether complex, heating to form 3-fluoroquinolines; intermediate for forming antibacterial compound AVENTIS PHARMA S.A. (US) 2005-08-18 US disclosed
WO-2005049575-A1 NOVEL METHOD OF PREPARING 3-FLUORINATED QUINOLINES NOVEXEL (FR) 2005-06-02 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-20050182259-A1 Subjecting a substituted quinoline-3-carboxamide compound to Hofmann degradation to obtain amine derivative, forming diazonium salt by reacting amine derivative with borontrifluoride-ethyl ether complex, heating to form 3-fluoroquinolines; intermediate for forming antibacterial compound QRFPR, NQO2, DHX35 CSF1R 598/4885JAK2 3680/4885HTR5A 137/4885

“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.