SCHEMBL5581537

SCHEMBL5581537

O=C(O)c1ccc(Oc2ccc(Cc3ccc(Oc4ccc(C(=O)O)cc4)cc3)cc2)cc1

nearest known ligand 0.89

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SRD5A2 P31213 7/20 0.89
PARP15 Q460N3 1/20 0.62
PARP10 Q53GL7 1/20 0.62
CA1 P00915 1/20 0.52
CA2 P00918 1/20 0.52
ALDH1A1 P00352 1/20 0.52
NR4A2 P43354 3/20 0.52
NR4A1 P22736 1/20 0.52
NR4A3 Q92570 1/20 0.52
RXRA P19793 4/20 0.51
RXRB P28702 4/20 0.51
NPC1 O15118 1/20 0.51
POLB P06746 1/20 0.51
RAB9A P51151 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
PTGES O14684 1/20 0.51
RXRG P48443 1/20 0.50
PKM P14618 1/20 0.50

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
SCHEMBL9243055 0.88 SRD5A2 (0.70) SRD5A2PARP15PARP10CA1CA2
SCHEMBL22281 0.87 PARP10 (0.78) SRD5A2PARP15PARP10CA1CA2
SCHEMBL766069 0.87 PARP10 (0.78) SRD5A2PARP15PARP10CA1CA2
Terephthalic Acid SCHEMBL9861713 0.87 PARP10 (0.78) SRD5A2PARP15PARP10CA1CA2
SCHEMBL5581520 0.87 PARP10 (0.78) SRD5A2PARP15PARP10CA1CA2
SCHEMBL68390 0.87 SRD5A2 (0.69) SRD5A2CA1CA2ALDH1A1RXRA
SCHEMBL8024751 0.86 SRD5A2 (0.68) SRD5A2PARP15PARP10CA1CA2
SCHEMBL9137849 0.85 SRD5A2 (0.75) SRD5A2NPC1POLBRAB9A
Hydrochloric Acid SCHEMBL25188150 0.84 SRD5A2 (0.67) SRD5A2CA1CA2ALDH1A1RXRA
Hydrochloric Acid SCHEMBL9633355 0.84 PARP10 (0.75) SRD5A2PARP15PARP10CA1CA2

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070148480-A1 Laminate TEIJIN LIMITED (JP) 2007-06-28 US disclosed
EP-1698460-A1 MULTILAYER BODY TEIJIN LIMITED (JP) 2006-09-06 EP disclosed
US-20060134407-A1 Adhesive sheet and layered product TEIJIN LIMITED (JP) 2006-06-22 US disclosed
EP-1589086-A1 ADHESIVE SHEET AND LAYERED PRODUCT TEIJIN LIMITED (JP) 2005-10-26 EP disclosed