SCHEMBL792186

SCHEMBL792186

O=C(Nc1cccnc1)c1cncc(C(F)(F)F)c1

nearest known ligand 0.68

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.68
▸ TSHR P16473 1/20 0.68
▸ KMT2A Q03164 1/20 0.68
▸ EPHX2 P34913 2/20 0.67
▸ LMNA P02545 1/20 0.64
▸ HIF1A Q16665 1/20 0.64
▸ CSF1R P07333 4/20 0.60
▸ BRAF P15056 2/20 0.60
▸ NPC1 O15118 1/20 0.59
▸ RAB9A P51151 1/20 0.59
▸ NAMPT P43490 3/20 0.58
▸ KIT P10721 1/20 0.58
▸ KDR P35968 1/20 0.58
▸ MAPK14 Q16539 1/20 0.58
▸ CYP11B1 P15538 4/20 0.58
▸ CYP11B2 P19099 4/20 0.58
▸ RXFP1 Q9HBX9 1/20 0.57
▸ USP36 Q9P275 1/20 0.56
▸ TRPA1 O75762 1/20 0.56

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
SCHEMBL29737572 1.00 MEN1 (0.68) MEN1TSHRKMT2AEPHX2LMNA
SCHEMBL27927283 0.86 EPHX2 (0.87) MEN1TSHRKMT2AEPHX2LMNA
SCHEMBL20526128 0.83 EPHX2 (0.62) MEN1TSHRKMT2AEPHX2LMNA
SCHEMBL5178391 0.81 MEN1 (1.00) MEN1TSHRKMT2AEPHX2LMNA
SCHEMBL30573525 0.81 USP36 (0.62) MEN1KMT2ANPC1RAB9AUSP36
SCHEMBL1571386 0.79 LMNA (1.00) MEN1KMT2ALMNAHIF1ANPC1
SCHEMBL790322 0.79 NAMPT (0.71) LMNAHIF1ACSF1RBRAFNPC1
SCHEMBL5665029 0.79 EPHX2 (0.76) MEN1TSHRKMT2AEPHX2LMNA
SCHEMBL30728660 0.79 P2RX1 (0.70) MEN1TSHRKMT2AEPHX2LMNA
SCHEMBL29615059 0.79 CA1 (0.62) MEN1TSHRKMT2ALMNAUSP36

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 5 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
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
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 MEN1 4198/4885TSHR 1290/4885KMT2A 1030/4885

“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.

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