SCHEMBL11272719

SCHEMBL11272719

CC(C)(C)n1ncc(NC(=O)NC(=O)c2c(Cl)cccc2Cl)c(Cl)c1=O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ITGB1 P05556 1/20 0.45
▸ ITGA4 P13612 1/20 0.45
▸ ITGB7 P26010 1/20 0.45
▸ SMN1; SMN2 Q16637 4/20 0.40
▸ LMNA P02545 2/20 0.40
▸ MEN1 O00255 3/20 0.40
▸ KMT2A Q03164 3/20 0.40
▸ MAPK1 P28482 3/20 0.40
▸ MAPT P10636 2/20 0.38
▸ GHSR Q92847 1/20 0.38
▸ MAPK14 Q16539 2/20 0.37
▸ PPIA P62937 1/20 0.37
▸ HTT P42858 2/20 0.37
▸ CRHBP P24387 1/20 0.37
▸ CRHR2 Q13324 1/20 0.37
▸ HPGD P15428 1/20 0.36
▸ ATM Q13315 1/20 0.36
▸ TSHR P16473 2/20 0.36
▸ RAB9A P51151 2/20 0.36
▸ NPC1 O15118 1/20 0.36

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
SCHEMBL11279223 0.93 MEN1 (0.48) ITGB1ITGA4ITGB7LMNAMEN1
SCHEMBL8658843 0.89 MEN1 (0.51) ITGB1ITGA4ITGB7SMN1; SMN2LMNA
SCHEMBL11285219 0.88 PYGL (0.46) SMN1; SMN2LMNAMEN1KMT2AMAPT
SCHEMBL11274211 0.81 PYGL (0.43) SMN1; SMN2LMNAHTTHPGDATM
SCHEMBL11278901 0.80 HTT (0.46) ITGB1ITGA4ITGB7SMN1; SMN2LMNA
SCHEMBL11273766 0.79 SMN1; SMN2 (0.47) ITGB1ITGA4ITGB7SMN1; SMN2LMNA
SCHEMBL11277938 0.78 PTGES (0.52) ITGB1ITGA4ITGB7SMN1; SMN2LMNA
SCHEMBL11277269 0.78 NPC1 (0.56) ITGB1ITGA4ITGB7SMN1; SMN2KMT2A
SCHEMBL11278294 0.77 CNR2 (0.49) ITGB1ITGA4ITGB7SMN1; SMN2MEN1
SCHEMBL11277798 0.77 ITGB1 (0.43) ITGB1ITGA4ITGB7SMN1; SMN2LMNA

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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