SCHEMBL11079975

SCHEMBL11079975

[O]C(=O)Oc1ccc(Cc2cc[c]cc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 1/20 0.49
SRD5A2 P31213 1/20 0.39
SAE1 Q9UBE0 1/20 0.38
UBA2 Q9UBT2 1/20 0.38
KMT2A Q03164 7/20 0.37
STS P08842 1/20 0.36
PPARG P37231 3/20 0.36
PPARA Q07869 3/20 0.36
THRB P10828 1/20 0.34
PTPN1 P18031 1/20 0.34
LTA4H P09960 1/20 0.33
LIPE Q05469 1/20 0.33
LMNA P02545 2/20 0.33
MAPK1 P28482 1/20 0.33
CASP3 P42574 1/20 0.33
SENP7 Q9BQF6 1/20 0.33
SENP6 Q9GZR1 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
HTT P42858 2/20 0.32
SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL9722328 0.82 RAB9A (0.34) ELANEKMT2ALMNAL3MBTL1HTT
SCHEMBL1176609 0.74 ALDH1A1 (0.45) KMT2ASTSLTA4HLMNAMAPK1
SCHEMBL11060885 0.74 LMNA (0.39) KMT2ASTSTHRBLMNAL3MBTL1
SCHEMBL9671534 0.72 RAB9A (0.54) ELANEKMT2APPARGPPARATHRB
SCHEMBL542479 0.72 LTA4H (0.63) SAE1UBA2LTA4HLMNASMN1; SMN2
SCHEMBL320687 0.72 CALM1 (0.44) KMT2AMAPK1SMN1; SMN2TDP1ALDH1A1
SCHEMBL2907705 0.71 ELANE (0.59) ELANESRD5A2SAE1UBA2KMT2A
SCHEMBL9542970 0.70 ELANE (0.57) ELANESRD5A2SAE1UBA2KMT2A
SCHEMBL9578942 0.70 ELANE (0.57) ELANESRD5A2SAE1UBA2KMT2A
SCHEMBL777803 0.70 ELANE (0.62) ELANESAE1UBA2KMT2ALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4472556-A DISPERSING POLYDIORGANOSILOXANE IN THERMOPLASTIC RESIN DOW CORNING CORPORATION (US) 1984-09-18 US disclosed