SCHEMBL6172379

SCHEMBL6172379

CC(=O)/C(=C/c1ccccc1)c1ccccc1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKR1C1 Q04828 3/20 0.70
MAPT P10636 6/20 0.59
HPGD P15428 5/20 0.59
MEN1 O00255 4/20 0.59
KMT2A Q03164 4/20 0.59
LMNA P02545 4/20 0.59
HTT P42858 3/20 0.59
ALDH1A1 P00352 2/20 0.59
KDM4E B2RXH2 1/20 0.59
POLB P06746 1/20 0.59
MAPK1 P28482 1/20 0.59
AKR1C3 P42330 3/20 0.55
AKR1C2 P52895 2/20 0.54
NPSR1 Q6W5P4 4/20 0.54
CYP2D6 P10635 2/20 0.54
CYP2C9 P11712 2/20 0.54
CYP2C19 P33261 2/20 0.54
PLA2G1B P04054 1/20 0.54
CYP1A2 P05177 1/20 0.54
ATG4B Q9Y4P1 1/20 0.54

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
SCHEMBL7992874 1.00 AKR1C1 (0.70) AKR1C1MAPTHPGDMEN1KMT2A
SCHEMBL5183481 1.00 AKR1C1 (0.70) AKR1C1MAPTHPGDMEN1KMT2A
SCHEMBL6168727 0.89 AKR1C1 (0.56) AKR1C1MAPTHPGDMEN1KMT2A
SCHEMBL6168722 0.89 AKR1C1 (0.56) AKR1C1MAPTHPGDMEN1KMT2A
SCHEMBL6169411 0.87 ALDH1A1 (0.55) AKR1C1MAPTHPGDMEN1KMT2A
SCHEMBL11079768 0.87 HTT (0.55) AKR1C1MAPTHPGDMEN1KMT2A
SCHEMBL6170117 0.87 MEN1 (0.62) AKR1C1MAPTHPGDMEN1KMT2A
SCHEMBL5253681 0.87 AKR1C1 (0.55) AKR1C1MAPTHPGDMEN1KMT2A
SCHEMBL6170114 0.87 MEN1 (0.62) AKR1C1MAPTHPGDMEN1KMT2A
SCHEMBL5253679 0.87 AKR1C1 (0.55) AKR1C1MAPTHPGDMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-60244595-A None JP disclosed
US-20230271998-A1 SOLID SUPPORT FOR SYNTHESIZING NUCLEIC ACID SEQUENCES AND METHODS FOR MAKING AND USING UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2023-08-31 US disclosed
EP-2641910-B1 CHIRAL SPIRO-PYRIDYLAMIDOPHOSPHINE LIGAND COMPOUND, SYNTHESIS METHOD THEREFOR AND APPLICATION THEREOF ZHEJIANG JIUZHOU PHARMA SCIENCE & TECH CO LTD (CN) 2017-06-28 EP disclosed
US-8962839-B2 Chiral spiro-pyridylamidophosphine ligand compound, synthesis method therefor and application thereof ZHEJIANG JIUZHOU PHARMA SCIENCE & TECHNOLOGY CO., LTD. (CN) 2015-02-24 US disclosed
US-8962839-B2 Chiral spiro-pyridylamidophosphine ligand compound, synthesis method therefor and application thereof ZHEJIANG JIUZHOU PHARMA SCIENCE & TECHNOLOGY CO., LTD. (CN) 2015-02-24 US disclosed
EP-2641910-A1 CHIRAL SPIRO-PYRIDYLAMIDOPHOSPHINE LIGAND COMPOUND, SYNTHESIS METHOD THEREFOR AND APPLICATION THEREOF Zhejiang Jiuzhou Pharma Science & Technology Co., Ltd. (CN) 2013-09-25 EP disclosed
US-20130225822-A1 CHIRAL SPIRO-PYRIDYLAMIDOPHOSPHINE LIGAND COMPOUND, SYNTHESIS METHOD THEREFOR AND APPLICATION THEREOF ZHEJIANG JIUZHOU PHARMA SCIENCE & TECHNOLOGY CO., LTD. (CN) 2013-08-29 US disclosed
US-20130225822-A1 CHIRAL SPIRO-PYRIDYLAMIDOPHOSPHINE LIGAND COMPOUND, SYNTHESIS METHOD THEREFOR AND APPLICATION THEREOF ZHEJIANG JIUZHOU PHARMA SCIENCE & TECHNOLOGY CO., LTD. (CN) 2013-08-29 US disclosed
EP-1528059-A2 Substituted isoxazoles for the treatment of inflammation G.D. Searle LLC (US) 2005-05-04 EP disclosed
EP-0809636-B1 SUBSTITUTED ISOXAZOLES FOR THE TREATMENT OF INFLAMMATION SEARLE & CO (US) 2002-09-04 EP disclosed
EP-1223167-A2 Substituted isoxazoles for the treatment of inflammation G.D. Searle & Co. (US) 2002-07-17 EP disclosed
US-5985902-A TREATING INFLAMMATION AND INFLAMMATION-ASSOCIATED DISORDERS, SUCH AS ARTHRITIS G.D. SEARLE & CO. (US) 1999-11-16 US disclosed
US-5859257-A ANTIINFLAMMATORY, ANTIARTHRITIC AGENTS G. D. SEARLE & CO. (US) 1999-01-12 US disclosed
US-5633272-A Substituted isoxazoles for the treatment of inflammation PHARMACIA & UPJOHN COMPANY LLC 1997-05-27 US disclosed
JP-S60244595-A THERMAL RECORDING MATERIAL RICOH CO LTD 1985-12-04 JP 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 (2 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-20130225822-A1 CHIRAL SPIRO-PYRIDYLAMIDOPHOSPHINE LIGAND COMPOUND, SYNTHESIS METHOD THEREFOR AND APPLICATION THEREOF WEE1, WEE2, NOTUM AKR1C1 861/4885MAPT 4720/4885HPGD 1030/4885
US-20230271998-A1 SOLID SUPPORT FOR SYNTHESIZING NUCLEIC ACID SEQUENCES AND METHODS FOR MAKING AND USING RNGTT, NSUN2, POLN AKR1C1 4237/4885MAPT 4759/4885HPGD 2953/4885

“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.