SCHEMBL9702850

SCHEMBL9702850

CC(C)c1cc(Oc2ccccc2F)cc(C(C)C)c1N=C=NC(C)(C)C

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
AR P10275 1/20 0.36
PARP10 Q53GL7 1/20 0.35
CARM1 Q86X55 2/20 0.32
PRMT6 Q96LA8 2/20 0.32
ALDH1A1 P00352 2/20 0.32
ESR1 P03372 1/20 0.32
LMNA P02545 1/20 0.31
TP53 P04637 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
MRGPRX1 Q96LB2 1/20 0.31
GAA P10253 1/20 0.31
GCK P35557 1/20 0.31

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
SCHEMBL9704788 0.85 XIAP (0.37) ARLMNASMN1; SMN2
SCHEMBL10396553 0.83 CARM1 (0.37) ARCARM1PRMT6ALDH1A1GAA
SCHEMBL2764978 0.83 BCL2 (0.35) ALDH1A1
SCHEMBL9704630 0.82 AR (0.38) ARPARP10CARM1PRMT6ALDH1A1
SCHEMBL9702892 0.76 PARP10 (0.43) ARPARP10CARM1PRMT6ALDH1A1
SCHEMBL8845542 0.71 LTA4H (0.40) ALDH1A1
SCHEMBL9703462 0.71 AR (0.36) ARPARP10CARM1PRMT6ALDH1A1
SCHEMBL8341904 0.70 ALDH1A1 (0.37) ALDH1A1LMNASMN1; SMN2GAA
SCHEMBL9636852 0.70 NPY5R (0.32)
SCHEMBL9701890 0.67 XIAP (0.40) ARLMNASMN1; SMN2

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
EP-0481921-A1 Substituted carbodiimides and thio-ureas and their utilisation against insects CIBA-GEIGY AG (CH) 1992-04-22 EP disclosed