SCHEMBL794273

SCHEMBL794273

[c]1nc(Cc2ccccc2)ns1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CALM1 P0DP23 1/20 0.42
L3MBTL1 Q9Y468 2/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
TAAR1 Q96RJ0 1/20 0.36
HRH3 Q9Y5N1 1/20 0.36
ALDH1A1 P00352 3/20 0.35
LTA4H P09960 1/20 0.35
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
RAB9A P51151 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
SORT1 Q99523 1/20 0.33
PDE4A P27815 1/20 0.33
PDE4B Q07343 1/20 0.33
PDE4C Q08493 1/20 0.33

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
SCHEMBL8649626 0.68 CALM1 (0.48) CALM1L3MBTL1MEN1KMT2ATAAR1
SCHEMBL2614741 0.68 CALM1 (0.61) CALM1L3MBTL1MEN1KMT2ATAAR1
SCHEMBL15323022 0.68 CALM1 (0.61) CALM1L3MBTL1MEN1KMT2ATAAR1
SCHEMBL381936 0.65 CALM1 (0.44) CALM1L3MBTL1MEN1KMT2ATAAR1
SCHEMBL460058 0.64 CALM1 (0.55) CALM1L3MBTL1MEN1KMT2ATAAR1
SCHEMBL2090656 0.64 CALM1 (0.42) CALM1L3MBTL1MEN1KMT2AALDH1A1
SCHEMBL794737 0.64 CALM1 (0.42) CALM1L3MBTL1MEN1KMT2ATAAR1
SCHEMBL206040 0.64 CALM1 (0.42) CALM1L3MBTL1ALDH1A1LTA4HRAB9A
SCHEMBL15323583 0.64 CALM1 (0.48) CALM1L3MBTL1MEN1KMT2ATAAR1
SCHEMBL2697397 0.64 CALM1 (0.48) CALM1L3MBTL1MEN1KMT2ATAAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10206401-B2 Pyridine compounds for controlling invertebrate pests II BASF SE (DE) 2019-02-19 US disclosed
US-20180116221-A1 Pyridine Compounds for Controlling Invertebrate Pests II BASF SE (DE) 2018-05-03 US disclosed
EP-2616458-B1 PYRIDINE COMPOUNDS FOR CONTROLLING INVERTEBRATE PESTS II BASF SE (DE) 2016-07-20 EP disclosed
US-20130203821-A1 Pyridine Compounds for Controlling Invertebrate Pests II BASF SE (DE) 2013-08-08 US disclosed
EP-2616458-A1 PYRIDINE COMPOUNDS FOR CONTROLLING INVERTEBRATE PESTS II BASF SE (DE) 2013-07-24 EP disclosed
WO-2012034960-A1 PYRIDINE COMPOUNDS FOR CONTROLLING INVERTEBRATE PESTS II 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 (3 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-10206401-B2 Pyridine compounds for controlling invertebrate pests II PRXL2A, NR2C2, SHROOM3 CALM1 1219/4885L3MBTL1 2367/4885MEN1 3766/4885
US-20180116221-A1 Pyridine Compounds for Controlling Invertebrate Pests II PRXL2A, SHROOM3, NR2C2 CALM1 1529/4885L3MBTL1 2339/4885MEN1 3879/4885
US-20130203821-A1 Pyridine Compounds for Controlling Invertebrate Pests II GRIN2A, NR2C2, GRIA2 CALM1 2010/4885L3MBTL1 2553/4885MEN1 4044/4885

“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.