SCHEMBL11029367

SCHEMBL11029367

Cc1cc(NC(=O)NC(=O)c2ccccc2Cl)c(C)c(Cl)c1Oc1ccc(Cl)c2c1CCCC2

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PYGL P06737 6/20 0.48
GCGR P47871 1/20 0.43
RAB9A P51151 2/20 0.40
POLB P06746 2/20 0.40
NPC1 O15118 1/20 0.40
PKM P14618 1/20 0.40
IDO1 P14902 2/20 0.39
TOP1 P11387 1/20 0.38
TDP1 Q9NUW8 2/20 0.37
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2C19 P33261 1/20 0.37
PCTP Q9UKL6 1/20 0.36
ALDH1A1 P00352 1/20 0.36
GAA P10253 1/20 0.36
MAPT P10636 1/20 0.36
KMT2A Q03164 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
HDAC1 Q13547 1/20 0.36
HDAC8 Q9BY41 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
SCHEMBL8663041 0.91 ALDH1A1 (0.48) PYGLRAB9APOLBNPC1TDP1
SCHEMBL9133491 0.90 PYGL (0.45) PYGLGCGRRAB9APOLBNPC1
SCHEMBL9137528 0.88 PYGL (0.53) PYGLGCGRRAB9APOLBNPC1
SCHEMBL10959798 0.87 GCGR (0.50) PYGLGCGRRAB9APOLBNPC1
SCHEMBL10961383 0.86 PYGL (0.51) PYGLGCGRRAB9APOLBNPC1
SCHEMBL8657108 0.86 PYGL (0.51) PYGLGCGRRAB9APOLBNPC1
SCHEMBL8659524 0.85 KMT2A (0.48) PYGLRAB9APOLBNPC1IDO1
SCHEMBL8659841 0.85 PYGL (0.52) PYGLGCGRRAB9APOLBNPC1
SCHEMBL8656634 0.85 PYGL (0.52) PYGLGCGRRAB9APOLBNPC1
SCHEMBL10961025 0.85 GCGR (0.51) PYGLGCGRRAB9APOLBNPC1

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
US-4426385-A Insecticidal bicyclooxyphenyl ureas UNION CARBIDE CORPORATION (US) 1984-01-17 US claimed
EP-0050321-A2 Novel bicyclooxyphenyl ureas, process for their preparation and pesticides containing them UNION CARBIDE CORPORATION (US) 1982-04-28 EP claimed