SCHEMBL7877291

SCHEMBL7877291

CCCc1cc(N(CC(O)Cn2ccnc2)C(C)C)ccc1O

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
AGER Q15109 1/20 0.37
POLB P06746 1/20 0.36
RAB9A P51151 1/20 0.34
CYP3A4 P08684 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 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
SCHEMBL9021033 0.78 ADRA2C (0.47) AGERCYP3A4MEN1KMT2A
SCHEMBL7877297 0.73 ADRB2 (0.38) AGERPOLBRAB9A
SCHEMBL7868757 0.72 IDH1 (0.38) AGERPOLBRAB9A
SCHEMBL8649123 0.71 CYP19A1 (0.41)
SCHEMBL17934931 0.64 AGER (0.51) AGER
SCHEMBL412063 0.64 AGER (0.51) AGER
SCHEMBL10247560 0.63 AGER (0.62) AGER
Hydrochloric Acid SCHEMBL411541 0.62 AGER (0.50) AGER
SCHEMBL15187342 0.62 TBXAS1 (0.51) AGER
SCHEMBL6306204 0.62 TBXAS1 (0.51) AGER

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-6326500-B1 ANTIINFLAMMATORY AGENTS; ANTIALLERGENS ABBOTT LABORATORIES 2001-12-04 US disclosed