SCHEMBL547658

SCHEMBL547658

O=Cc1ccc2c(ccc3ccccc32)c1C=O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPRT1 P00492 4/20 0.54
ERN1 O75460 1/20 0.52
PADI4 Q9UM07 1/20 0.47
TDP1 Q9NUW8 3/20 0.46
POLB P06746 2/20 0.46
PTPN1 P18031 2/20 0.46
ALDH1A1 P00352 2/20 0.46
HSD17B10 Q99714 2/20 0.46
CYP2A6 P11509 1/20 0.46
TSHR P16473 1/20 0.46
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
PAX8 Q06710 1/20 0.45
MAPT P10636 3/20 0.44
CYP1A2 P05177 1/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
CYP3A4 P08684 2/20 0.42
LMNA P02545 1/20 0.42
APEX1 P27695 1/20 0.42

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
SCHEMBL27716373 1.00 HPRT1 (0.54) HPRT1ERN1PADI4TDP1POLB
SCHEMBL197337 0.90 ERN1 (0.62) HPRT1ERN1PADI4TDP1POLB
SCHEMBL31663413 0.90 ERN1 (0.62) HPRT1ERN1PADI4TDP1POLB
SCHEMBL20357461 0.83 ERN1 (0.55) HPRT1ERN1PADI4TDP1POLB
SCHEMBL547664 0.81 ERN1 (0.49) HPRT1ERN1PADI4TDP1POLB
SCHEMBL5549581 0.81 TDP1 (0.43) ERN1PADI4TDP1ALDH1A1CYP2A6
SCHEMBL548120 0.80 HPRT1 (0.58) HPRT1ERN1TDP1POLBPTPN1
SCHEMBL17384097 0.80 HPRT1 (0.58) HPRT1ERN1TDP1POLBPTPN1
SCHEMBL27633490 0.80 HPRT1 (0.58) HPRT1ERN1TDP1POLBPTPN1
SCHEMBL10615396 0.79 ERN1 (0.82) HPRT1ERN1PADI4ALDH1A1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4102873-A SEMICONDUCTORS THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 1978-07-25 US claimed
CN-111116528-B Method for producing aromatic primary diamine 罗地亚经营管理公司 2023-08-01 CN disclosed
US-11066377-B2 Process for producing aromatic primary diamines RHODIA OPERATIONS (FR) 2021-07-20 US disclosed
CN-108008600-B Radiation-sensitive composition 三菱瓦斯化学株式会社 2021-02-09 CN disclosed
US-10899726-B2 Process for producing aromatic primary diamines RHODIA OPERATIONS (FR) 2021-01-26 US disclosed
EP-2080750-B1 RADIATION-SENSITIVE COMPOSITION MITSUBISHI GAS CHEMICAL CO (JP) 2020-07-29 EP disclosed
EP-3674285-A1 PROCESS FOR PRODUCING M-XYLYLENEDIAMINE RHODIA OPERATIONS (FR) 2020-07-01 EP disclosed
US-20200172501-A1 PROCESS FOR PRODUCING AROMATIC PRIMARY DIAMINES SPECIALTY OPERATIONS FRANCE (FR) 2020-06-04 US disclosed
CN-111116528-A Process for producing aromatic primary diamines 罗地亚经营管理公司 2020-05-08 CN disclosed
EP-3166921-B1 PROCESS FOR PRODUCING AROMATIC PRIMARY DIAMINES RHODIA OPERATIONS (FR) 2020-02-19 EP disclosed
WO-2005104264-A1 ELECTROLUMINESCENT POLYMERS AND USE THEROF MERCK PATENT GMBH (DE) 2005-11-03 WO disclosed
US-4136107-A MONOMERS FOR CYANO-CONDENSATION RESINS FOR USE IN SEMICONDUCTORS THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 1979-01-23 US disclosed
US-4136107-A MONOMERS FOR CYANO-CONDENSATION RESINS FOR USE IN SEMICONDUCTORS THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 1979-01-23 US disclosed
US-4133889-A ANAPHYLAXIS ANTAGONISTS FISONS, LTD. (GB) 1979-01-09 US disclosed
US-4116945-A ELECTRICAL CONDUCTING PHTHALONITRILE POLYMERS THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 1978-09-26 US disclosed
US-4116945-A ELECTRICAL CONDUCTING PHTHALONITRILE POLYMERS THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 1978-09-26 US disclosed
US-4102873-A SEMICONDUCTORS THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 1978-07-25 US disclosed
US-4102873-A SEMICONDUCTORS THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 1978-07-25 US disclosed
US-4057569-A SEMICONDUCTORS THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 1977-11-08 US disclosed
US-4057569-A SEMICONDUCTORS THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 1977-11-08 US disclosed