SCHEMBL5792985

SCHEMBL5792985

O=C(CCCCC(=O)Oc1ccc(C(=O)O)cc1)Oc1ccc(C(=O)O)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.59
HSD17B10 Q99714 2/20 0.52
HTT P42858 2/20 0.52
ALDH1A1 P00352 2/20 0.52
LMNA P02545 1/20 0.52
MAPT P10636 1/20 0.52
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
PRSS1 P07477 1/20 0.49
PRSS2 P07478 1/20 0.49
PRSS3 P35030 1/20 0.49
PKM P14618 1/20 0.48
TP53 P04637 2/20 0.48
TSHR P16473 2/20 0.48
ELANE P08246 1/20 0.47
ESR1 P03372 1/20 0.47
RECQL P46063 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
HIF1A Q16665 1/20 0.47
MEN1 O00255 1/20 0.47

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
SCHEMBL6863945 0.98 KMT2A (0.58) KMT2AHSD17B10HTTALDH1A1LMNA
SCHEMBL6866158 0.96 KMT2A (0.55) KMT2AHSD17B10HTTALDH1A1LMNA
SCHEMBL5792981 0.94 KMT2A (0.54) KMT2AHSD17B10HTTALDH1A1LMNA
SCHEMBL12411508 0.93 KMT2A (0.53) KMT2AHSD17B10HTTALDH1A1LMNA
SCHEMBL28410126 0.93 KMT2A (0.53) KMT2AHSD17B10HTTALDH1A1LMNA
SCHEMBL6863947 0.93 KMT2A (0.53) KMT2AHSD17B10HTTALDH1A1LMNA
SCHEMBL8140171 0.91 TP53 (0.61) KMT2AHTTTP53TSHRESR1
SCHEMBL12902938 0.91 KMT2A (0.51) KMT2AHSD17B10HTTALDH1A1LMNA
SCHEMBL6866162 0.91 PDE4B (0.51) KMT2AHSD17B10HTTALDH1A1LMNA
SCHEMBL7777446 0.90 TP53 (0.64) KMT2AHTTTP53TSHRESR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117384076-A Novel polymer, diamine compound, liquid crystal aligning agent, liquid crystal alignment film, and liquid crystal display element 日产化学株式会社 2024-01-12 CN disclosed
CN-117384078-A Novel polymer, diamine compound, liquid crystal aligning agent, liquid crystal alignment film, and liquid crystal display element 日产化学株式会社 2024-01-12 CN disclosed
CN-117384077-A Novel polymer, diamine compound, liquid crystal aligning agent, liquid crystal alignment film, and liquid crystal display element 日产化学株式会社 2024-01-12 CN disclosed
CN-111263761-B Novel polymer and diamine compound 日产化学株式会社 2022-11-04 CN disclosed
CN-111263761-A Novel polymer and diamine compound 日产化学株式会社 2020-06-09 CN disclosed
WO-2004064762-A9 NOVEL COCRYSTALLIZATION S S C I INC (US) 2006-07-27 WO disclosed