SCHEMBL9701403

SCHEMBL9701403

Nc1cccc(C(=O)OC(=O)c2ccccc2)c1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PBRM1 Q86U86 1/20 0.63
LMNA P02545 2/20 0.48
F2 P00734 2/20 0.48
ADRB2 P07550 2/20 0.48
ADRB1 P08588 2/20 0.48
ADRB3 P13945 2/20 0.48
POLB P06746 2/20 0.46
NPC1 O15118 1/20 0.46
MITF O75030 1/20 0.46
PLG P00747 1/20 0.46
PRSS1 P07477 1/20 0.46
PRSS2 P07478 1/20 0.46
PRSS3 P35030 1/20 0.46
TSHR P16473 1/20 0.45
ALDH1A1 P00352 3/20 0.44
KMT2A Q03164 2/20 0.44
MAPT P10636 2/20 0.44
HDAC1 Q13547 1/20 0.43
CHRNB2 P17787 1/20 0.43
CHRNA4 P43681 1/20 0.43

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
SCHEMBL29071827 0.94 PBRM1 (0.55) PBRM1LMNAF2ADRB2ADRB1
SCHEMBL8003710 0.94 PBRM1 (0.59) PBRM1LMNAF2ADRB2ADRB1
SCHEMBL1417358 0.91 PBRM1 (0.52) PBRM1LMNAF2ADRB2ADRB1
SCHEMBL28539853 0.86 PBRM1 (0.55) PBRM1LMNAF2ADRB2ADRB1
SCHEMBL8066993 0.86 LMNA (0.50) PBRM1LMNAF2POLBNPC1
SCHEMBL545343 0.86 LMNA (0.58) LMNAF2POLBTSHRALDH1A1
SCHEMBL9950105 0.85 PBRM1 (0.53) PBRM1LMNAF2ADRB2ADRB1
SCHEMBL4654816 0.84 LOXL2 (0.53) PBRM1LMNAF2ADRB2ADRB1
SCHEMBL248078 0.82 NPC1 (0.56) PBRM1LMNAF2POLBNPC1
SCHEMBL8613426 0.81 PBRM1 (0.59) PBRM1LMNAPRSS1ALDH1A1KMT2A

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
EP-0507576-A1 Polypropylene-based resin compositions TOSOH CORPORATION (JP) 1992-10-07 EP disclosed