SCHEMBL11244237

SCHEMBL11244237

CCCC1(CCC)COC(CCn2ccnc2)(Cc2ccc(C(C)(C)C)cc2)OC1

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.43
MEN1 O00255 1/20 0.43
POLB P06746 1/20 0.43
HMOX1 P09601 3/20 0.36
LMNA P02545 1/20 0.35
HTT P42858 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
KDM4E B2RXH2 1/20 0.35
GAA P10253 1/20 0.35
MAPT P10636 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
IDO1 P14902 1/20 0.35

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
SCHEMBL11242390 0.93 KMT2A (0.44) KMT2AMEN1POLBHMOX1LMNA
SCHEMBL11243141 0.91 HMOX1 (0.43) KMT2AMEN1POLBHMOX1
SCHEMBL11229193 0.88 CYP19A1 (0.45) HMOX1
SCHEMBL11245915 0.88 KMT2A (0.46) KMT2AMEN1POLBHMOX1LMNA
SCHEMBL11244504 0.87 HMOX1 (0.49) HMOX1
SCHEMBL11239102 0.87 HMOX1 (0.47) HMOX1
SCHEMBL11235305 0.87 CYP19A1 (0.42) KMT2APOLBHMOX1MAPT
SCHEMBL11251782 0.87 KMT2A (0.48) KMT2AMEN1POLBHMOX1LMNA
SCHEMBL11249904 0.85 MEN1 (0.45) KMT2AMEN1LMNAKDM4EMAPT
SCHEMBL11245199 0.85 KMT2A (0.46) KMT2AMEN1POLBHMOX1LMNA

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
EP-0049565-A2 Derivatives of substituted N-alkylimidazoles, their preparation and pharmaceutical compositions containing them SYNTEX (U.S.A.) INC. (US) 1982-04-14 EP disclosed
US-4321272-A Derivatives of substituted N-alkylimidazoles SYNTEX (U.S.A.) INC. (US) 1982-03-23 US disclosed