SCHEMBL11273766

SCHEMBL11273766

O=C(NC(=O)c1c(Cl)cccc1Cl)Nc1cnn(-c2cc(Cl)cc(Cl)c2)c(=O)c1Cl

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 4/20 0.47
▸ KMT2A Q03164 2/20 0.47
▸ PKM P14618 2/20 0.47
▸ HTT P42858 2/20 0.43
▸ CYP1A2 P05177 1/20 0.43
▸ CYP2C9 P11712 1/20 0.43
▸ RAB9A P51151 6/20 0.42
▸ NPC1 O15118 4/20 0.42
▸ PTGES O14684 1/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ PAX8 Q06710 2/20 0.39
▸ NPSR1 Q6W5P4 1/20 0.39
▸ RXFP1 Q9HBX9 1/20 0.39
▸ ITGB1 P05556 1/20 0.39
▸ ITGA4 P13612 1/20 0.39
▸ ITGB7 P26010 1/20 0.39
▸ MAPT P10636 3/20 0.39
▸ ALDH1A1 P00352 2/20 0.39
▸ MITF O75030 1/20 0.39
▸ S1PR4 O95977 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
SCHEMBL11278901 0.92 HTT (0.46) SMN1; SMN2KMT2APKMHTTCYP1A2
SCHEMBL11277938 0.88 PTGES (0.52) SMN1; SMN2KMT2APKMHTTCYP1A2
SCHEMBL11282702 0.88 PYGL (0.48) SMN1; SMN2KMT2APKMHTTCYP1A2
SCHEMBL11276599 0.88 TLR7 (0.43) SMN1; SMN2KMT2APKMHTTCYP1A2
SCHEMBL11277269 0.85 NPC1 (0.56) SMN1; SMN2KMT2AHTTCYP1A2CYP2C9
SCHEMBL11273156 0.85 MAPK14 (0.49) SMN1; SMN2KMT2APKMITGB1ITGA4
SCHEMBL11274203 0.82 TLR7 (0.52) KMT2ANPC1PTGESMEN1MAPT
SCHEMBL11267025 0.80 HTT (0.48) SMN1; SMN2KMT2APKMHTTCYP1A2
SCHEMBL11272719 0.79 ITGB1 (0.45) SMN1; SMN2KMT2AHTTRAB9ANPC1
SCHEMBL11277798 0.78 ITGB1 (0.43) SMN1; SMN2KMT2APKMHTTCYP1A2

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-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
EP-0063413-A1 1-Benzoyl-3-(heterocyclic)ureas, compositions, and insecticidal method ELI LILLY AND COMPANY (US) 1982-10-27 — — EP disclosed
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