SCHEMBL4972255

SCHEMBL4972255

O=C(O)C(=C/c1ccccc1)/C(=C\c1ccccc1)C(=O)O

nearest known ligand 0.90

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.68
HTT P42858 1/20 0.64
AKR1C3 P42330 2/20 0.60
AKR1C1 Q04828 2/20 0.58
MEN1 O00255 1/20 0.55
KMT2A Q03164 1/20 0.55
ALDH1A1 P00352 2/20 0.54
TSHR P16473 1/20 0.54
CYP2C9 P11712 2/20 0.52
CYP3A4 P08684 1/20 0.52
RECQL P46063 2/20 0.46
MAPT P10636 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
HDAC3 O15379 1/20 0.46
TNKS O95271 1/20 0.46
HDAC4 P56524 1/20 0.46
HDAC1 Q13547 1/20 0.46
HCAR2 Q8TDS4 1/20 0.46
HDAC7 Q8WUI4 1/20 0.46
HDAC2 Q92769 1/20 0.46

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
SCHEMBL4972259 1.00 TP53 (0.68) TP53HTTAKR1C3AKR1C1MEN1
SCHEMBL39098 0.95 TP53 (0.75) TP53HTTAKR1C3AKR1C1MEN1
SCHEMBL29898330 0.95 TP53 (0.75) TP53HTTAKR1C3AKR1C1MEN1
SCHEMBL7277760 0.90 TP53 (0.63) TP53HTTAKR1C3AKR1C1MEN1
SCHEMBL7277756 0.90 TP53 (0.63) TP53HTTAKR1C3AKR1C1MEN1
SCHEMBL4793304 0.88 TP53 (0.61) TP53HTTAKR1C3AKR1C1MEN1
SCHEMBL13860589 0.88 TP53 (0.67) TP53HTTAKR1C3AKR1C1MEN1
SCHEMBL21051764 0.88 TP53 (0.61) TP53HTTAKR1C3AKR1C1MEN1
SCHEMBL4793303 0.88 TP53 (0.61) TP53HTTAKR1C3AKR1C1MEN1
SCHEMBL15484230 0.86 TP53 (0.59) TP53HTTAKR1C3AKR1C1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1990332-A1 NAPHTHACENE DERIVATIVE AND ORGANIC ELECTROLUMINESCENT DEVICE USING SAME Idemitsu Kosan Co., Ltd. (JP) 2008-11-12 EP disclosed
US-20070222373-A1 NAPHTHACENE DERIVATIVE AND ORGANIC ELECTROLUMINESCENT DEVICE USING THE SAME IDEMITSU KOSAN CO., LTD. (JP) 2007-09-27 US disclosed
EP-1091958-A1 SALTS OF PAROXETINE SMITHKLINE BEECHAM PLC (GB) 2001-04-18 EP disclosed
WO-2000001692-A1 SALTS OF PAROXETINE SMITHKLINE BEECHAM PLC (GB) 2000-01-13 WO disclosed
US-5639789-A ANTITHROMBOTIC DRUGS TANABE SEIYAKU CO., LTD. (JP) 1997-06-17 US disclosed
EP-0563798-B1 Butadiene derivatives, their preparation and use as an antithrombotic agent TANABE SEIYAKU CO (JP) 1997-06-11 EP disclosed
US-5514815-A ANTITHROMBOTIC AGENTS TANABE SEIYAKU CO., LTD. (JP) 1996-05-07 US disclosed
EP-0563798-A1 Butadiene derivatives, their preparation and use as an antithrombotic agent TANABE SEIYAKU CO., LTD. (JP) 1993-10-06 EP 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-20070222373-A1 NAPHTHACENE DERIVATIVE AND ORGANIC ELECTROLUMINESCENT DEVICE USING THE SAME ENDOD1, ENO1, CELA1 TP53 2572/4885HTT 3780/4885AKR1C3 3115/4885

“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.