SCHEMBL11273034

SCHEMBL11273034

O=C(NC(=O)c1ccccc1Br)Nc1cnn(-c2cc(C(F)(F)F)cc(C(F)(F)F)c2)c(=O)c1Cl

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 4/20 0.41
▸ RXFP1 Q9HBX9 1/20 0.40
▸ MAPT P10636 4/20 0.39
▸ NPC1 O15118 3/20 0.39
▸ RAB9A P51151 2/20 0.39
▸ NPSR1 Q6W5P4 1/20 0.39
▸ CYP1A2 P05177 1/20 0.39
▸ CYP2C9 P11712 1/20 0.39
▸ HTT P42858 1/20 0.39
▸ NPBWR1 P48145 1/20 0.39
▸ MCHR1 Q99705 1/20 0.39
▸ PYGL P06737 1/20 0.39
▸ PKM P14618 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ CCR1 P32246 4/20 0.37
▸ GAA P10253 1/20 0.37
▸ HPGD P15428 2/20 0.37
▸ TRPC3 Q13507 1/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ PSMD14 O00487 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
SCHEMBL11271650 0.93 RXFP1 (0.46) SMN1; SMN2RXFP1MAPTCYP1A2CYP2C9
SCHEMBL8669219 0.91 GAA (0.46) RXFP1MAPTNPC1RAB9ANPSR1
SCHEMBL11276064 0.85 HTT (0.46) SMN1; SMN2RXFP1MAPTNPC1RAB9A
SCHEMBL9135913 0.85 GAA (0.45) SMN1; SMN2RXFP1MAPTNPC1RAB9A
SCHEMBL11286892 0.84 RXFP1 (0.48) SMN1; SMN2RXFP1MAPTNPBWR1MCHR1
SCHEMBL11276599 0.84 TLR7 (0.43) SMN1; SMN2MAPTNPC1RAB9ANPSR1
SCHEMBL11283145 0.83 MAPK14 (0.47) SMN1; SMN2RXFP1MAPTCYP1A2CYP2C9
SCHEMBL11274203 0.81 TLR7 (0.52) MAPTNPC1NPBWR1MCHR1KMT2A
SCHEMBL11286418 0.79 RXFP1 (0.46) SMN1; SMN2RXFP1MAPTHTTNPBWR1
SCHEMBL11282702 0.78 PYGL (0.48) SMN1; SMN2RXFP1MAPTNPC1RAB9A

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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