SCHEMBL9634541

SCHEMBL9634541

CCOc1ccc(-c2cc(-c3ccc(OCC)cc3O)nc(-c3ccccc3)n2)c(O)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 8/20 0.58
GAA P10253 2/20 0.58
MAPK10 P53779 1/20 0.58
CNR1 P21554 1/20 0.55
CNR2 P34972 1/20 0.55
GPR55 Q9Y2T6 1/20 0.55
IDH1 O75874 1/20 0.49
MEN1 O00255 5/20 0.47
KMT2A Q03164 5/20 0.47
NTSR1 P30989 1/20 0.47
TP53 P04637 3/20 0.47
SMN1; SMN2 Q16637 3/20 0.47
KDM4E B2RXH2 3/20 0.47
MAPK1 P28482 2/20 0.47
ESR1 P03372 1/20 0.46
MAPT P10636 5/20 0.46
USP2 O75604 2/20 0.46
ALDH1A1 P00352 2/20 0.46
NPC1 O15118 2/20 0.46
RAB9A P51151 2/20 0.46

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
SCHEMBL9634226 0.97 LMNA (0.56) LMNAGAAMAPK10CNR1CNR2
SCHEMBL9635984 0.92 LMNA (0.54) LMNAGAAMAPK10CNR1CNR2
SCHEMBL9635558 0.91 LMNA (0.53) LMNAGAAMAPK10CNR1CNR2
SCHEMBL1468002 0.90 LMNA (0.60) LMNAGAAMAPK10CNR1CNR2
SCHEMBL29375339 0.90 LMNA (0.60) LMNAGAAMAPK10CNR1CNR2
SCHEMBL9635991 0.88 ADORA3 (0.50) LMNAGAAMAPK10CNR1CNR2
SCHEMBL10070443 0.87 LMNA (0.57) LMNAGAAMAPK10CNR1CNR2
SCHEMBL9635572 0.87 IDH1 (0.51) LMNAGAAMAPK10IDH1MEN1
SCHEMBL13506418 0.85 LMNA (0.55) LMNAGAAMAPK10CNR1CNR2
SCHEMBL9635563 0.83 PTPN11 (0.54) IDH1MEN1KMT2ANTSR1SMN1; 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0280654-B1 PROCESS FOR IMPROVING THE PHOTOCHEMICAL STABILITY OF DYEINGS ON FIBROUS POLYESTER MATERIALS CIBA-GEIGY AG (CH) 1992-05-13 EP disclosed
US-4895981-A Using ultraviolet absorber CIBA-GEIGY CORPORATION (US) 1990-01-23 US disclosed