SCHEMBL1798210

SCHEMBL1798210

Cc1cc(-c2cncc(F)c2)cc(C(=O)Nc2cccnc2)n1

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
CYP11B2 P19099 5/20 0.49
CYP11B1 P15538 3/20 0.49
TSHR P16473 1/20 0.47
TP53 P04637 2/20 0.47
NPC1 O15118 2/20 0.47
RAB9A P51151 2/20 0.47
ALDH1A1 P00352 1/20 0.47
PKM P14618 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
NAMPT P43490 2/20 0.46
LMNA P02545 1/20 0.46
CYP1A2 P05177 2/20 0.46
CYP2C9 P11712 2/20 0.46
CYP3A4 P08684 1/20 0.45

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
SCHEMBL1792907 0.90 CYP1A2 (0.48) NPC1RAB9AALDH1A1SMN1; SMN2CYP1A2
SCHEMBL1795787 0.86 SMN1; SMN2 (0.52) NPC1RAB9AALDH1A1SMN1; SMN2CYP1A2
SCHEMBL1795347 0.86 CYP1A2 (0.48) TP53NPC1RAB9AALDH1A1SMN1; SMN2
SCHEMBL1793853 0.84 CYP1A2 (0.50) CYP1A2CYP2C9CYP3A4
SCHEMBL1798156 0.83 CYP1A2 (0.48) CYP1A2CYP2C9CYP3A4
SCHEMBL1797133 0.82 GRM4 (0.49) HSD17B10TSHRTP53NPC1RAB9A
SCHEMBL1795478 0.79 CYP1A2 (0.54) CYP1A2CYP2C9CYP3A4
SCHEMBL30761123 0.79 CYP1A2 (0.69) CYP1A2CYP2C9CYP3A4
SCHEMBL1798177 0.77 GRM5 (0.53) HSD17B10
SCHEMBL1796965 0.77 CYP3A4 (0.70) TSHRTP53NPC1RAB9AALDH1A1

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
US-7951824-B2 4-aryl-pyridine-2-carboxyamide derivatives HOFFMAN-LA ROCHE INC. (US) 2011-05-31 US claimed
EP-1987003-A1 PYRIDINE-2-CARBOXAMIDE DERIVATIVES F.HOFFMANN-LA ROCHE AG (CH) 2008-11-05 EP claimed
WO-2007093542-A1 PYRIDINE-2-CARBOXAMIDE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2007-08-23 WO claimed
US-20070197553-A1 4-Aryl-pyridine-2-carboxyamide derivatives HOFFMANN-LA ROCHE INC. 2007-08-23 US claimed
US-7951824-B2 4-aryl-pyridine-2-carboxyamide derivatives HOFFMAN-LA ROCHE INC. (US) 2011-05-31 US disclosed
EP-1987003-A1 PYRIDINE-2-CARBOXAMIDE DERIVATIVES F.HOFFMANN-LA ROCHE AG (CH) 2008-11-05 EP disclosed
WO-2007093542-A1 PYRIDINE-2-CARBOXAMIDE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2007-08-23 WO disclosed
US-20070197553-A1 4-Aryl-pyridine-2-carboxyamide derivatives HOFFMANN-LA ROCHE INC. 2007-08-23 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-20070197553-A1 4-Aryl-pyridine-2-carboxyamide derivatives GRM2, GRM1, GRM3 HSD17B10 3520/4885TDP1 4492/4885CYP11B2 2896/4885

“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.