SCHEMBL70738

SCHEMBL70738

CCCc1c(C)cc(O)cc1O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.45
HPGD P15428 1/20 0.45
MAPK1 P28482 1/20 0.45
HTT P42858 1/20 0.45
RAB9A P51151 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
CYP3A4 P08684 6/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
PTPN1 P18031 1/20 0.43
PTPN11 Q06124 1/20 0.43
APP P05067 1/20 0.42
MAOB P27338 1/20 0.42
SLC28A3 Q9HAS3 1/20 0.42
ACHE P22303 2/20 0.41
CNR1 P21554 1/20 0.41
CNR2 P34972 1/20 0.41
PGAM1 P18669 1/20 0.41
CHRM1 P11229 1/20 0.39
ALOX15 P16050 1/20 0.39

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
SCHEMBL16009969 0.89 HTT (0.59) NPC1HPGDMAPK1HTTRAB9A
SCHEMBL18704816 0.89 CYP3A4 (0.44) NPC1HPGDMAPK1HTTRAB9A
SCHEMBL6832976 0.86 HTT (0.52) NPC1HPGDMAPK1HTTRAB9A
SCHEMBL31061257 0.86 PTGS2 (0.55) NPC1HPGDMAPK1HTTRAB9A
SCHEMBL16010537 0.86 PTGS2 (0.55) NPC1HPGDMAPK1HTTRAB9A
SCHEMBL2046505 0.83 HTT (0.50) NPC1HPGDMAPK1HTTRAB9A
SCHEMBL12806548 0.82 CYP3A4 (0.46) NPC1HPGDMAPK1HTTRAB9A
SCHEMBL23387402 0.81 HTT (0.59) NPC1HPGDMAPK1HTTRAB9A
SCHEMBL23387411 0.81 PTPN1 (0.46) NPC1HPGDMAPK1HTTRAB9A
SCHEMBL1179417 0.78 PTPN1 (0.56) NPC1HPGDMAPK1HTTRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11042090-B2 Composition for forming organic film SHIN-ETSU CHEMICAL CO., LTD. (JP) 2021-06-22 US disclosed
US-20190041752-A1 COMPOSITION FOR FORMING ORGANIC FILM SHIN-ETSU CHEMICAL CO., LTD. (JP) 2019-02-07 US disclosed
EP-2479203-A1 AROMATIC POLYESTER Muroran Institute of Technology (JP) 2012-07-25 EP disclosed
US-20120172570-A1 AROMATIC POLYESTER NITTA CORPORATION 2012-07-05 US disclosed
US-8129493-B2 Aromatic polyester MURORAN INSTITUTE OF TECHNOLOGY (JP) 2012-03-06 US disclosed
US-20110224343-A1 MODIFIER FOR AROMATIC POLYESTER AND AROMATIC POLYESTER RESIN COMPOSITION COMPRISING THE SAME MURORAN INSTITUTE OF TECHNOLOGY (JP) 2011-09-15 US disclosed
US-20110092662-A1 AROMATIC POLYESTER NITTA CORPORATION (JP) 2011-04-21 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110224343-A1 MODIFIER FOR AROMATIC POLYESTER AND AROMATIC POLYESTER RESIN COMPOSITION COMPRISING THE SAME F12, PHAX, WDR82 NPC1 4583/4885HPGD 3275/4885MAPK1 3382/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.