SCHEMBL318807

SCHEMBL318807

O=C(CCCI)c1ccccc1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 3/20 0.72
MAPT P10636 3/20 0.72
L3MBTL1 Q9Y468 2/20 0.72
LMNA P02545 2/20 0.72
HDAC1 Q13547 5/20 0.64
HDAC8 Q9BY41 5/20 0.64
HDAC3 O15379 1/20 0.64
HDAC4 P56524 1/20 0.64
HDAC7 Q8WUI4 1/20 0.64
HDAC2 Q92769 1/20 0.64
HDAC10 Q969S8 1/20 0.64
HDAC11 Q96DB2 1/20 0.64
HDAC6 Q9UBN7 1/20 0.64
HDAC9 Q9UKV0 1/20 0.64
HDAC5 Q9UQL6 1/20 0.64
NPC1 O15118 1/20 0.62
CASP3 P42574 1/20 0.62
RAB9A P51151 1/20 0.62
SENP8 Q96LD8 1/20 0.62
SENP7 Q9BQF6 1/20 0.62

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
Ethylene SCHEMBL8094844 0.96 TDP1 (0.67) TDP1MAPTL3MBTL1LMNAHDAC1
SCHEMBL2209431 0.86 TDP1 (0.64) TDP1MAPTL3MBTL1LMNAHDAC1
SCHEMBL7068671 0.86 TDP1 (0.95) TDP1MAPTL3MBTL1LMNAHDAC1
SCHEMBL1052631 0.86 TDP1 (0.86) TDP1MAPTL3MBTL1LMNAHDAC1
SCHEMBL94885 0.84 L3MBTL1 (0.75) TDP1MAPTL3MBTL1LMNAHDAC1
SCHEMBL9057671 0.84 TDP1 (1.00) TDP1MAPTL3MBTL1LMNAHDAC1
SCHEMBL8519287 0.84 TDP1 (1.00) TDP1MAPTL3MBTL1LMNAHDAC1
SCHEMBL27516050 0.84 TDP1 (1.00) TDP1MAPTL3MBTL1LMNAHDAC1
SCHEMBL95197 0.83 TDP1 (0.79) TDP1MAPTL3MBTL1LMNAHDAC1
SCHEMBL28065139 0.82 TDP1 (0.78) TDP1MAPTL3MBTL1LMNAHDAC1

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 33 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0213883-B1 NOVEL RADIOACTIVE AND NON-RADIOACTIVE IODOBUTYROPHENONE DERIVATIVE AND PROCESSES FOR THE PREPARATION THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1989-11-02 EP claimed
JP-56157858-A None JP disclosed
EP-3138841-A1 D2 ANTAGONISTS, METHODS OF SYNTHESIS AND METHODS OF USE Altos Therapeutics, LLC (US) 2017-03-08 EP disclosed
EP-3138841-A1 D2 ANTAGONISTS, METHODS OF SYNTHESIS AND METHODS OF USE Altos Therapeutics, LLC (US) 2017-03-08 EP disclosed
EP-2582701-B1 D2 ANTAGONISTS, METHODS OF SYNTHESIS AND METHODS OF USE ALTOS THERAPEUTICS LLC (US) 2016-11-02 EP disclosed
CN-103052636-B D 2antagonist and synthetic method thereof and using method Altos Therapeutics, LLC (US) 2016-03-09 CN disclosed
US-9156840-B2 D2 antagonists, methods of synthesis and methods of use Altos Therapeutics, LLC (US) 2015-10-13 US disclosed
US-9156840-B2 D2 antagonists, methods of synthesis and methods of use Altos Therapeutics, LLC (US) 2015-10-13 US disclosed
US-9156840-B2 D2 antagonists, methods of synthesis and methods of use Altos Therapeutics, LLC (US) 2015-10-13 US disclosed
US-20140350005-A1 D2 ANTAGONISTS, METHODS OF SYNTHESIS AND METHODS OF USE TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2014-11-27 US disclosed
EP-0788478-A1 AZETIDINONE DERIVATIVES FOR THE TREATMENT OF ATHEROSCLEROSIS SMITHKLINE BEECHAM PLC (GB) 1997-08-13 EP disclosed
WO-1996013484-A1 AZETIDINONE DERIVATIVES FOR THE TREATMENT OF ATHEROSCLEROSIS SMITHKLINE BEECHAM PLC (GB) 1996-05-09 WO disclosed
US-5380736-A Cholecystokinin and gastric antagonist ELF SANOFI (FR) 1995-01-10 US disclosed
US-5314889-A Hormone antagonists ELF SANOFI (FR) 1994-05-24 US disclosed
EP-0518731-A1 Heterocyclic derivatives of substituted 2-acylamino 5-thiazole, their preparation and pharmaceutical compositions containing them SANOFI (FR) 1992-12-16 EP disclosed
US-4739060-A Radioactive and non-radioactive iodobutyrophenone derivative SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1988-04-19 US disclosed
EP-0213883-A1 Novel radioactive and non-radioactive iodobutyrophenone derivative and processes for the preparation thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1987-03-11 EP disclosed
JP-S56157858-A MEASURING METHOD FOR BUTYLOPHENON MEDICINES IN ORGANISM SAMPLE IN WHICH RADIOACTIVE IODIZED BUTYPHENON DERIVATIVE IS USED AS MARK ANTIGEN SUMITOMO CHEM CO LTD 1981-12-05 JP disclosed
US-4022786-A PHARMACEUTICALS, CNS STIMULANT BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DT) 1977-05-10 US disclosed
US-4016280-A 4,4-Diarylpiperidine compositions and use BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DT) 1977-04-05 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-20140350005-A1 D2 ANTAGONISTS, METHODS OF SYNTHESIS AND METHODS OF USE DRD2, DRD3, AVPR2 TDP1 4179/4885MAPT 3767/4885L3MBTL1 2998/4885

“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.