SCHEMBL11282236

SCHEMBL11282236

O=C(NC(=O)c1ccccc1Cl)Nc1cnn(C2CCCCC2)c(=O)c1Cl

nearest known ligand 0.48

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ CNR2 P34972 1/20 0.48
▸ PYGL P06737 3/20 0.44
▸ KMT2A Q03164 4/20 0.42
▸ MEN1 O00255 3/20 0.42
▸ EPHB3 P54753 1/20 0.42
▸ PPIA P62937 1/20 0.41
▸ ITGA4 P13612 1/20 0.41
▸ ITGB7 P26010 1/20 0.41
▸ RAB9A P51151 4/20 0.40
▸ NPC1 O15118 2/20 0.40
▸ TDP1 Q9NUW8 2/20 0.40
▸ MAPT P10636 2/20 0.40
▸ L3MBTL1 Q9Y468 2/20 0.40
▸ LMNA P02545 1/20 0.40
▸ MAPK1 P28482 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.39
▸ TSHR P16473 1/20 0.39

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
SCHEMBL11285295 0.90 CNR2 (0.47) CNR2PYGLKMT2AITGA4ITGB7
SCHEMBL11278294 0.88 CNR2 (0.49) CNR2KMT2AMEN1PPIAITGA4
SCHEMBL11267025 0.78 HTT (0.48) PYGLKMT2AEPHB3RAB9ANPC1
SCHEMBL11285219 0.78 PYGL (0.46) PYGLKMT2AMEN1EPHB3PPIA
SCHEMBL11282702 0.77 PYGL (0.48) PYGLKMT2AMEN1EPHB3RAB9A
SCHEMBL11276626 0.76 NPC1 (0.49) PYGLKMT2AMEN1EPHB3RAB9A
SCHEMBL11281409 0.75 PYGL (0.44) PYGLKMT2AMEN1EPHB3RAB9A
SCHEMBL8669219 0.72 GAA (0.46) PYGLEPHB3RAB9ANPC1TDP1
SCHEMBL9832964 0.71 TDP1 (0.47) PYGLPPIARAB9ANPC1TDP1
SCHEMBL11283145 0.71 MAPK14 (0.47) PYGLKMT2AMEN1MAPTLMNA

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
EP-0063413-A1 1-Benzoyl-3-(heterocyclic)ureas, compositions, and insecticidal method ELI LILLY AND COMPANY (US) 1982-10-27 — — EP claimed
US-4366155-A 1-Benzoyl-3-(6-oxopyridazinyl)ureas, compositions, and insecticidal method ELI LILLY AND COMPANY (US) 1982-12-28 — — US disclosed
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