SCHEMBL16018368

SCHEMBL16018368

Cc1ccccc1C(=O)N[C@H]1C[C@@H]1F

nearest known ligand 0.58

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.58
RAB9A P51151 1/20 0.58
SMN1; SMN2 Q16637 3/20 0.51
KMT2A Q03164 3/20 0.51
MEN1 O00255 2/20 0.51
GLA P06280 1/20 0.51
HPGD P15428 2/20 0.49
TAS1R3 Q7RTX0 2/20 0.48
TAS1R1 Q7RTX1 2/20 0.48
TAS1R2 Q8TE23 2/20 0.48
P2RX7 Q99572 1/20 0.48
POLB P06746 2/20 0.47
ALDH1A1 P00352 1/20 0.45
HCRTR1 O43613 1/20 0.45
HCRTR2 O43614 1/20 0.45
ALOX15 P16050 1/20 0.44

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
SCHEMBL13193072 0.85 NPC1 (0.59) NPC1RAB9ASMN1; SMN2KMT2AMEN1
SCHEMBL27544844 0.83 NPC1 (0.58) NPC1RAB9ASMN1; SMN2KMT2AMEN1
SCHEMBL15271409 0.83 NPC1 (0.58) NPC1RAB9ASMN1; SMN2KMT2AMEN1
SCHEMBL30848490 0.82 NPC1 (0.65) NPC1RAB9ASMN1; SMN2KMT2AMEN1
SCHEMBL15983801 0.81 NPC1 (0.73) NPC1RAB9ASMN1; SMN2KMT2AMEN1
SCHEMBL29954061 0.80 CTSD (0.55) NPC1RAB9ASMN1; SMN2KMT2AMEN1
SCHEMBL457993 0.77 NPC1 (0.84) NPC1RAB9ASMN1; SMN2KMT2AMEN1
SCHEMBL13638925 0.77 HSD17B10 (0.70) NPC1RAB9ASMN1; SMN2KMT2AMEN1
SCHEMBL13888629 0.77 NPC1 (0.58) NPC1RAB9ASMN1; SMN2KMT2AMEN1
SCHEMBL13638867 0.76 NPC1 (0.54) NPC1RAB9ASMN1; SMN2KMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140255392-A1 SUBSTITUTED IMIDAZOPYRIDINES AND INTERMEDIATES THEREOF BAYER INTELLECTUAL PROPERTY GMBH (DE) 2014-09-11 US disclosed
US-20140255392-A1 SUBSTITUTED IMIDAZOPYRIDINES AND INTERMEDIATES THEREOF BAYER INTELLECTUAL PROPERTY GMBH (DE) 2014-09-11 US 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-20140255392-A1 SUBSTITUTED IMIDAZOPYRIDINES AND INTERMEDIATES THEREOF FLT4, KDR, VEGFA NPC1 2593/4885RAB9A 2032/4885SMN1; SMN2 1402/4885

“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.