SCHEMBL789957

SCHEMBL789957

N#Cc1cc(Cl)ccc1Oc1ccc(C(=O)Nc2cccnc2)cn1

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CYP11B2 P19099 3/20 0.54
CYP11B1 P15538 2/20 0.54
NAMPT P43490 1/20 0.52
LRRK2 Q5S007 1/20 0.48
LMNA P02545 4/20 0.48
SLC22A12 Q96S37 1/20 0.48
CXCR1 P25024 1/20 0.48
CXCR2 P25025 1/20 0.48
MEN1 O00255 3/20 0.48
KMT2A Q03164 3/20 0.48
KDM4E B2RXH2 1/20 0.47
MAPT P10636 1/20 0.47
MAPK1 P28482 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
GAA P10253 1/20 0.47
KCNMA1 Q12791 1/20 0.47
HIF1A Q16665 1/20 0.46

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
SCHEMBL15093308 0.87 MEN1 (0.60) CYP11B2CYP11B1NAMPTLRRK2LMNA
SCHEMBL15093633 0.87 NOTUM (0.60) CYP11B2CYP11B1NAMPTLMNACXCR1
SCHEMBL15093148 0.85 CYP11B2 (0.59) CYP11B2CYP11B1NAMPTLMNACXCR1
SCHEMBL791892 0.80 CYP11B1 (0.68) CYP11B2CYP11B1NAMPTLMNACXCR1
SCHEMBL789625 0.80 GRM5 (0.64) CYP11B2CYP11B1NAMPTMEN1KMT2A
SCHEMBL790643 0.79 RAB9A (0.58) CYP11B2CYP11B1NAMPTLMNACXCR1
SCHEMBL15093116 0.79 CYP11B1 (0.60) CYP11B2CYP11B1NAMPTLMNACXCR1
SCHEMBL790001 0.79 SLC22A12 (0.41) SLC22A12KMT2AMAPTMAPK1SMN1; SMN2
SCHEMBL791160 0.78 CYP11B1 (0.70) CYP11B2CYP11B1LMNACXCR1CXCR2
SCHEMBL791672 0.77 GRM5 (0.61) CYP11B2CYP11B1CXCR1CXCR2MAPK1

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
EP-2615917-A2 PYRIDINE COMPOUNDS FOR CONTROLLING INVERTEBRATE PESTS III BASF SE (DE) 2013-07-24 EP disclosed
US-20130180014-A1 Pyridine Compounds for Controlling Invertebrate Pests III BASF SE (DE) 2013-07-11 US disclosed
WO-2012034959-A2 PYRIDINE COMPOUNDS FOR CONTROLLING INVERTEBRATE PESTS III BASF SE (DE) 2012-03-22 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-20130180014-A1 Pyridine Compounds for Controlling Invertebrate Pests III CHRM1, CHRM2, GRIN2C CYP11B2 308/4885CYP11B1 396/4885NAMPT 4575/4885

“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.