SCHEMBL4318324

SCHEMBL4318324

O=C(O)c1ccc(C=Cc2ccc(F)cn2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 6/20 0.51
KCNH2 Q12809 3/20 0.51
HTR2C P28335 2/20 0.50
NPC1 O15118 2/20 0.49
RAB9A P51151 2/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
PIM1 P11309 1/20 0.49
KDM4E B2RXH2 1/20 0.49
MEN1 O00255 1/20 0.49
POLB P06746 1/20 0.49
KMT2A Q03164 1/20 0.49
BCL2L1 Q07817 1/20 0.46
BAD Q92934 1/20 0.46
TNFRSF1A P19438 1/20 0.45
ALDH1A1 P00352 1/20 0.43
FBP1 P09467 1/20 0.42
HSD11B1 P28845 1/20 0.41
MAP4K4 O95819 1/20 0.40
ENPP2 Q13822 1/20 0.40
NFE2L2 Q16236 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
SCHEMBL4318319 1.00 HTR2A (0.51) HTR2AKCNH2HTR2CNPC1RAB9A
SCHEMBL26643226 0.90 HTR2A (0.55) HTR2AKCNH2HTR2CNPC1RAB9A
SCHEMBL26643229 0.90 HTR2A (0.55) HTR2AKCNH2HTR2CNPC1RAB9A
SCHEMBL31516476 0.90 HTR2A (0.55) HTR2AKCNH2HTR2CNPC1RAB9A
SCHEMBL28619676 0.82 BCL2L1 (0.65) KMT2ABCL2L1BADTNFRSF1AALDH1A1
SCHEMBL4325659 0.79 KMT2A (0.49) HTR2AKCNH2SMN1; SMN2KDM4EMEN1
SCHEMBL4325655 0.79 KMT2A (0.49) HTR2AKCNH2SMN1; SMN2KDM4EMEN1
SCHEMBL11472328 0.78 MEN1 (0.52) NPC1RAB9ASMN1; SMN2PIM1KDM4E
SCHEMBL11472332 0.78 MEN1 (0.52) NPC1RAB9ASMN1; SMN2PIM1KDM4E
SCHEMBL69167 0.76 ALDH1A1 (0.68) SMN1; SMN2POLBKMT2AALDH1A1FBP1

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-7566781-B2 Imidazopyridine compound BANYU PHARMACEUTICAL CO., LTD. (JP) 2009-07-28 US disclosed
US-20070249659-A1 melanin concentrating hormone receptor antagonist; preventing or treating vascular system diseases, nervous system disorders, metabolic disorders, urogenital diseases, respiratory diseases disorders; N-(2-ethyl-3-methylimidazo[1,2-a]pyridin-6-yl)-3-fluoro-4-(pyridin-2-ylmethoxy)benzamide BANYU PHARMACEUTICAL., LTD. (JP) 2007-10-25 US disclosed
EP-1748048-A1 IMIDAZOPYRIDINE COMPOUND BANYU PHARMACEUTICAL CO., LTD. (JP) 2007-01-31 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-20070249659-A1 melanin concentrating hormone receptor antagonist; preventing or treating vascular system diseases, nervous system disorders, metabolic disorders, urogenital diseases, respiratory diseases disorders; N-(2-ethyl-3-methylimidazo[1,2-a]pyridin-6-yl)-3-fluoro-4-(pyridin-2-ylmethoxy)benzamide MC1R, MCHR2, MCHR1 HTR2A 41/4885KCNH2 1882/4885HTR2C 29/4885

“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.