SCHEMBL4467910

SCHEMBL4467910

O=C(O)c1ncc(-c2ccc(F)nc2)cn1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 1/20 0.48
CYP2A6 P11509 3/20 0.46
CYP2B6 P20813 3/20 0.46
CYP2E1 P05181 1/20 0.46
CYP3A4 P08684 2/20 0.42
CYP2C19 P33261 2/20 0.42
JAK2 O60674 1/20 0.41
RET P07949 1/20 0.41
KDR P35968 1/20 0.41
GSK3A P49840 1/20 0.41
RPS6KA3 P51812 1/20 0.41
LIMK1 P53667 1/20 0.41
MAP2K1 Q02750 1/20 0.41
DYRK1A Q13627 1/20 0.41
MAPK14 Q16539 1/20 0.41
CLK4 Q9HAZ1 1/20 0.41
ALK Q9UM73 1/20 0.41
DYRK1B Q9Y463 1/20 0.41
CYP11B2 P19099 1/20 0.39
MCHR1 Q99705 1/20 0.39

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
SCHEMBL30526873 0.83 NPC1 (0.43) KMOMAPTEGLN1MAP4K4
SCHEMBL4465941 0.82 BCL2L1 (0.55) DHODHKDRKMOEGLN1MAP4K4
SCHEMBL29788190 0.81 BCL2L1 (0.59) DHODHCYP2A6CYP2B6CYP2E1JAK2
SCHEMBL2042090 0.81 BCL2L1 (0.59) DHODHCYP2A6CYP2B6CYP2E1JAK2
SCHEMBL26104326 0.78 CYP2A6 (0.64) DHODHCYP2A6CYP2B6CYP2E1CYP3A4
SCHEMBL2225522 0.75 SMN1; SMN2 (0.54) KMOMAP4K4
SCHEMBL4459958 0.74 KMO (0.60) DHODHKDRGSK3ADYRK1AKMO
SCHEMBL4778549 0.74 DHODH (0.46) DHODHCYP2A6CYP2B6CYP2E1CYP3A4
SCHEMBL4254452 0.74 KMO (0.59) DHODHKMOMAP4K4
SCHEMBL30240830 0.73 DHODH (0.58) DHODHCYP2A6CYP2B6CYP3A4CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7504412-B2 Imidazopyridine derivatives BANYU PHARMACEUTICALS, CO., LTD. (JP) 2009-03-17 US disclosed
US-20080200494-A1 Imidazopyridine Derivatives MSD K.K. (JP) 2008-08-21 US disclosed
EP-1657242-A1 IMIDAZOPYRIDINE DERIVATIVES Banyu Pharmaceutical Co., Ltd. (JP) 2006-05-17 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-20080200494-A1 Imidazopyridine Derivatives MC1R, MC3R, MC5R DHODH 3205/4885CYP2A6 341/4885CYP2B6 258/4885

“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.