SCHEMBL28155352

SCHEMBL28155352

O=C1CCC(O)(c2ccc(NC(=O)O)cc2)CC1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
CYP2C9 P11712 1/20 0.38
ALDH1A1 P00352 3/20 0.38
KDM4E B2RXH2 1/20 0.38
GRIN2B Q13224 5/20 0.37
SMN1; SMN2 Q16637 2/20 0.35
NPC1 O15118 3/20 0.35
RAB9A P51151 2/20 0.35
LMNA P02545 1/20 0.35
THRB P10828 1/20 0.33
OPRM1 P35372 1/20 0.33
OPRK1 P41145 1/20 0.33
OPRL1 P41146 1/20 0.33
HDAC1 Q13547 1/20 0.33

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
SCHEMBL28148358 0.81 KMT2A (0.42) MEN1KMT2ACYP2C9GRIN2BNPC1
SCHEMBL16424192 0.80 LMNA (0.50) CYP2C9ALDH1A1NPC1RAB9ALMNA
SCHEMBL615625 0.78 PSMB8 (0.46)
SCHEMBL613284 0.77 OPRM1 (0.49) MEN1KMT2ACYP2C9OPRM1OPRK1
SCHEMBL613248 0.76 MEN1 (0.63) MEN1KMT2ACYP2C9ALDH1A1OPRM1
SCHEMBL612855 0.74 ESR2 (0.43) MEN1KMT2ACYP2C9GRIN2B
SCHEMBL743825 0.73 KMT2A (0.39) MEN1KMT2ACYP2C9OPRM1OPRK1
SCHEMBL613615 0.73 OPRM1 (0.45) MEN1KMT2ACYP2C9GRIN2BSMN1; SMN2
SCHEMBL613957 0.73 DRD2 (0.58) MEN1KMT2AALDH1A1LMNAOPRM1
SCHEMBL15349268 0.73 OPRM1 (0.45) MEN1KMT2ACYP2C9OPRM1OPRK1

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
CN-106827028-B Carbon tetrachloride dispensing feeding-distribution device and its method of work in a kind of processing underground water 徐州工程学院 2018-06-29 CN claimed
CN-106827028-A Carbon tetrachloride dispensing feeding-distribution device and its method of work in one kind treatment underground water 徐州工程学院 2017-06-13 CN claimed
CN-106827028-B Carbon tetrachloride dispensing feeding-distribution device and its method of work in a kind of processing underground water 徐州工程学院 2018-06-29 CN disclosed
CN-106827028-A Carbon tetrachloride dispensing feeding-distribution device and its method of work in one kind treatment underground water 徐州工程学院 2017-06-13 CN disclosed