SCHEMBL11282702

SCHEMBL11282702

O=C(NC(=O)c1ccccc1Cl)Nc1cnn(-c2cc(Cl)cc(Cl)c2)c(=O)c1Cl

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PYGL P06737 3/20 0.48
▸ HTT P42858 2/20 0.44
▸ CYP1A2 P05177 2/20 0.44
▸ CYP2C9 P11712 1/20 0.44
▸ SMN1; SMN2 Q16637 4/20 0.43
▸ PKM P14618 2/20 0.43
▸ KMT2A Q03164 2/20 0.43
▸ EPHB3 P54753 1/20 0.43
▸ GCGR P47871 1/20 0.41
▸ RAB9A P51151 7/20 0.41
▸ NPC1 O15118 5/20 0.41
▸ POLB P06746 2/20 0.41
▸ NPSR1 Q6W5P4 1/20 0.41
▸ RXFP1 Q9HBX9 1/20 0.41
▸ ALDH1A1 P00352 3/20 0.40
▸ MAPT P10636 2/20 0.40
▸ MITF O75030 1/20 0.40
▸ S1PR4 O95977 1/20 0.40
▸ THRB P10828 1/20 0.40
▸ XBP1 P17861 1/20 0.40

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
SCHEMBL11267025 0.92 HTT (0.48) PYGLHTTCYP1A2CYP2C9SMN1; SMN2
SCHEMBL11276626 0.88 NPC1 (0.49) PYGLHTTCYP1A2CYP2C9SMN1; SMN2
SCHEMBL8669219 0.88 GAA (0.46) PYGLHTTCYP1A2CYP2C9EPHB3
SCHEMBL11273766 0.88 SMN1; SMN2 (0.47) HTTCYP1A2CYP2C9SMN1; SMN2PKM
SCHEMBL11283145 0.84 MAPK14 (0.47) PYGLHTTCYP1A2CYP2C9SMN1; SMN2
SCHEMBL11276064 0.82 HTT (0.46) PYGLHTTCYP1A2CYP2C9SMN1; SMN2
SCHEMBL11283690 0.82 PYGL (0.45) PYGLHTTSMN1; SMN2PKMKMT2A
SCHEMBL11278901 0.80 HTT (0.46) HTTCYP1A2CYP2C9SMN1; SMN2PKM
SCHEMBL11285219 0.79 PYGL (0.46) PYGLHTTCYP1A2CYP2C9SMN1; SMN2
SCHEMBL11281409 0.79 PYGL (0.44) PYGLHTTSMN1; SMN2PKMKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4366155-A 1-Benzoyl-3-(6-oxopyridazinyl)ureas, compositions, and insecticidal method ELI LILLY AND COMPANY (US) 1982-12-28 — — US claimed
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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