SCHEMBL27713992

SCHEMBL27713992

Cc1cc(C)cc(C)c1.O=C(Cl)C(Cl)Cl

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TPMT P51580 1/20 0.46
ALDH1A1 P00352 2/20 0.41
HTT P42858 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
RXRA P19793 1/20 0.37
RXRB P28702 1/20 0.37
TSHR P16473 2/20 0.36
HCAR1 Q9BXC0 1/20 0.34
MEN1 O00255 3/20 0.34
KMT2A Q03164 3/20 0.34
HPGD P15428 2/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
GPR35 Q9HC97 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2D6 P10635 1/20 0.34
CYP2C19 P33261 1/20 0.34
HTR3E A5X5Y0 1/20 0.34
NR1I2 O75469 1/20 0.34
HTR3B O95264 1/20 0.34
HTR3A P46098 1/20 0.34

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
SCHEMBL28175905 0.80 TPMT (0.39) TPMTALDH1A1HTTNPSR1RXRA
SCHEMBL2072660 0.79 TPMT (0.52) TPMTALDH1A1HTTNPSR1RXRA
SCHEMBL5846489 0.75 TPMT (0.39) TPMTALDH1A1HTTNPSR1RXRA
SCHEMBL1331263 0.74
SCHEMBL186056 0.74
SCHEMBL1332066 0.74
SCHEMBL347092 0.72 TPMT (0.59) TPMTALDH1A1NPSR1RXRARXRB
SCHEMBL2437624 0.72 TPMT (0.46) TPMTALDH1A1HTTNPSR1RXRA
SCHEMBL28121434 0.72 TPMT (0.46) TPMTALDH1A1HTTNPSR1RXRA
SCHEMBL27720237 0.72 TPMT (0.46) TPMTALDH1A1HTTNPSR1RXRA

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
CN-101250173-B Preparation method of spiromesifen UNIV ZHEJIANG 2010-06-16 CN disclosed
CN-101250173-A Preparation method of spiromesifen UNIV ZHEJIANG (CN) 2008-08-27 CN disclosed