SCHEMBL6535116

SCHEMBL6535116

O=C(O)OOCc1cccc2c1Cc1ccccc1-2

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PNMT P11086 1/20 0.53
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
HTR7 P34969 2/20 0.41
HTR2B P41595 2/20 0.41
DRD2 P14416 3/20 0.40
DRD4 P21917 2/20 0.40
DRD3 P35462 2/20 0.40
SRD5A2 P31213 1/20 0.38
HSP90AA1 P07900 2/20 0.36
PTGER4 P35408 3/20 0.35
PTGER3 P43115 3/20 0.35
PTGER1 P34995 2/20 0.35
PTGER2 P43116 2/20 0.35
KDM4E B2RXH2 1/20 0.35
MEN1 O00255 1/20 0.35
ALDH1A1 P00352 1/20 0.35
MAPT P10636 1/20 0.35
KMT2A Q03164 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL6535107 0.90 PNMT (0.54) PNMTNPC1RAB9AHTR7HTR2B
SCHEMBL647004 0.87 PNMT (0.51) PNMTNPC1RAB9AHTR7HTR2B
SCHEMBL7036967 0.87 PNMT (0.55) PNMTNPC1RAB9AHTR7HTR2B
SCHEMBL1830400 0.85 PNMT (0.55) PNMTNPC1RAB9AHTR7HTR2B
SCHEMBL7406401 0.81 PNMT (0.45) PNMTNPC1RAB9AHTR7HTR2B
SCHEMBL1830397 0.81 PNMT (0.57) PNMTNPC1RAB9AHTR7HTR2B
SCHEMBL7699410 0.81 PNMT (0.50) PNMTNPC1RAB9AHTR7HTR2B
Benzene SCHEMBL28021305 0.80 PNMT (0.53) PNMTNPC1RAB9AHTR7HTR2B
Glycine SCHEMBL15362023 0.80 PNMT (0.56) PNMTNPC1RAB9AHTR7HTR2B
SCHEMBL8671794 0.79 PNMT (0.55) PNMTNPC1RAB9AHTR7HTR2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2012131077-A1 SOMATOSTATIN MIMETICS NATIONAL UNIVERSITY OF IRELAND, GALWAY (IE) 2012-10-04 WO claimed
US-11333976-B2 Resin, photosensitive resin composition, electronic component and display device using the same TORAY INDUSTRIES, INC. (JP) 2022-05-17 US disclosed
WO-2012131077-A1 SOMATOSTATIN MIMETICS NATIONAL UNIVERSITY OF IRELAND, GALWAY (IE) 2012-10-04 WO disclosed
EP-1027070-A4 CONJUGATE HEAT SHOCK PROTEIN-BINDING PEPTIDES SLOAN KETTERING INSTITUTEFOR C (US) 2004-08-18 EP disclosed
US-20030194409-A1 Conjugate heat shock protein-binding peptides ROTHMAN JAMES E (US) 2003-10-16 US disclosed
US-20030166530-A1 Conjugate heat shock protein-binding peptides ROTHMAN JAMES E (US) 2003-09-04 US disclosed
US-20030134787-A1 Conjugate heat shock protein-binding peptides ROTHMAN JAMES E (US) 2003-07-17 US disclosed
EP-1027070-A1 CONJUGATE HEAT SHOCK PROTEIN-BINDING PEPTIDES Sloan-Kettering Institute For Cancer Research (US) 2000-08-16 EP disclosed
WO-1999022761-A9 CONJUGATE HEAT SHOCK PROTEIN-BINDING PEPTIDES SLOAN KETTERING INST CANCER (US) 1999-08-12 WO disclosed
WO-1999022761-A1 CONJUGATE HEAT SHOCK PROTEIN-BINDING PEPTIDES SLOAN-KETTERING INSTITUTE FOR CANCER RESEARCH (US) 1999-05-14 WO 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-11333976-B2 Resin, photosensitive resin composition, electronic component and display device using the same EED, RPL19, RARA PNMT 2745/4885NPC1 4393/4885RAB9A 716/4885

“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.