SCHEMBL10480581

SCHEMBL10480581

CCCCCC(=O)Oc1ccc(C=CC(=O)c2ccc(OC)cc2)c(O)c1

nearest known ligand 0.59

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GABRA3 P34903 1/20 0.55
GABRA2 P47869 1/20 0.55
GABRB2 P47870 1/20 0.55
TNFRSF1A P19438 1/20 0.52
PTPN1 P18031 5/20 0.51
DPP4 P27487 3/20 0.51
MAPT P10636 2/20 0.48
P4HB P07237 1/20 0.48
CALM1 P0DP23 1/20 0.48
RAB9A P51151 1/20 0.48
MEN1 O00255 1/20 0.48
ALDH1A1 P00352 1/20 0.48
F3 P13726 1/20 0.48
XDH P47989 1/20 0.48
KMT2A Q03164 1/20 0.48
CHRNA7 P36544 1/20 0.48
ABCG2 Q9UNQ0 2/20 0.47
CXCL12 P48061 1/20 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
SCHEMBL10480580 1.00 GABRA3 (0.55) GABRA3GABRA2GABRB2TNFRSF1APTPN1
SCHEMBL10828123 0.83 F3 (0.66) TNFRSF1AMAPTP4HBCALM1RAB9A
SCHEMBL10828126 0.83 F3 (0.66) TNFRSF1AMAPTP4HBCALM1RAB9A
SCHEMBL28339980 0.82 GABRA3 (0.78) GABRA3GABRA2GABRB2TNFRSF1APTPN1
SCHEMBL4139154 0.82 GABRA3 (0.78) GABRA3GABRA2GABRB2TNFRSF1APTPN1
SCHEMBL10828389 0.82 F3 (0.64) TNFRSF1AMAPTP4HBCALM1RAB9A
SCHEMBL10828386 0.82 F3 (0.64) TNFRSF1AMAPTP4HBCALM1RAB9A
SCHEMBL30383182 0.80 APP (0.68) MAPTRAB9AMEN1ALDH1A1KMT2A
SCHEMBL2804858 0.80 APP (0.68) MAPTRAB9AMEN1ALDH1A1KMT2A
SCHEMBL32662671 0.80 APP (0.68) MAPTRAB9AMEN1ALDH1A1KMT2A

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
US-4867964-A SUNSCREEN L'OREAL (FR) 1989-09-19 US claimed
US-4867964-A SUNSCREEN L'OREAL (FR) 1989-09-19 US disclosed