SCHEMBL13265121

SCHEMBL13265121

Bc1ccc(OC(C)C)cc1C(C)O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.44
▸ KMT2A Q03164 2/20 0.43
▸ PARP10 Q53GL7 1/20 0.42
▸ POLB P06746 1/20 0.40
▸ GLA P06280 1/20 0.39
▸ BRD4 O60885 1/20 0.38
▸ BRPF1 P55201 1/20 0.38
▸ ALDH1A3 P47895 1/20 0.36
▸ RXRA P19793 1/20 0.35
▸ RXRB P28702 1/20 0.35
▸ PDK2 Q15119 1/20 0.35
▸ MCL1 Q07820 1/20 0.35
▸ LMNA P02545 2/20 0.34
▸ TP53 P04637 2/20 0.34
▸ MAPK1 P28482 1/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ GAA P10253 1/20 0.34
▸ KDM4E B2RXH2 1/20 0.34
▸ HPGD P15428 1/20 0.34
▸ HSD17B10 Q99714 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
SCHEMBL14703043 0.83 ADRA2A (0.49) KMT2AMAPK1MEN1
SCHEMBL13263785 0.80 MEN1 (0.47) ALDH1A1KMT2APARP10TP53MEN1
SCHEMBL6742113 0.78 ALDH1A1 (0.44) ALDH1A1KMT2APARP10POLBGLA
SCHEMBL6745168 0.78 ALDH1A1 (0.44) ALDH1A1KMT2APARP10POLBGLA
SCHEMBL13265124 0.74 ALDH1A1 (0.58) ALDH1A1KMT2APARP10POLBGLA
SCHEMBL12203680 0.72 LMNA (0.42) ALDH1A1LMNATP53HPGDHSD17B10
SCHEMBL10187311 0.72 CA12 (0.42) ALDH1A1KMT2APARP10POLBBRD4
SCHEMBL24013661 0.71 MEN1 (0.40) KMT2AMEN1
SCHEMBL12202047 0.71 MEN1 (0.40) KMT2AMEN1
SCHEMBL12889913 0.70 ALDH1A1 (0.47) ALDH1A1KMT2APARP10POLBGLA

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
WO-2010074088-A1 CYCLIC AMINE COMPOUNDS 第一三共株式会社 (JP) 2010-07-01 — — WO disclosed
Send feedback