SCHEMBL4677491

SCHEMBL4677491

COC(=O)C(CCl)c1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.58
ESR1 P03372 1/20 0.47
ESR2 Q92731 1/20 0.47
MEN1 O00255 3/20 0.46
TSHR P16473 1/20 0.45
L3MBTL1 Q9Y468 2/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
PTGS1 P23219 1/20 0.44
PTGS2 P35354 1/20 0.44
ALDH1A1 P00352 1/20 0.44
LMNA P02545 1/20 0.44
CYP3A4 P08684 1/20 0.43
CYP2C19 P33261 1/20 0.43
KCNQ2 O43526 1/20 0.43
MAPT P10636 1/20 0.43

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
SCHEMBL29213125 0.91 KMT2A (0.49) KMT2AESR1ESR2MEN1TSHR
SCHEMBL27846661 0.86 KMT2A (0.55) KMT2AESR1ESR2MEN1TSHR
SCHEMBL27640925 0.84 ESR1 (0.68) KMT2AESR1ESR2L3MBTL1PTGS1
SCHEMBL8550655 0.84 SMN1; SMN2 (0.54) KMT2AMEN1TSHRSMN1; SMN2MAPT
SCHEMBL18381729 0.83 KMT2A (0.60) KMT2AMEN1L3MBTL1ALDH1A1LMNA
SCHEMBL174166 0.83 KMT2A (0.60) KMT2AMEN1L3MBTL1ALDH1A1LMNA
SCHEMBL30870371 0.83 KMT2A (0.60) KMT2AESR1ESR2MEN1TSHR
SCHEMBL5812804 0.83 KMT2A (0.60) KMT2AESR1ESR2MEN1TSHR
SCHEMBL18381730 0.83 KMT2A (0.60) KMT2AMEN1L3MBTL1ALDH1A1LMNA
SCHEMBL29425354 0.83 KMT2A (0.60) KMT2AMEN1L3MBTL1ALDH1A1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108276374-B Flavonoid aromatase inhibitor and preparation method and application thereof 天津科技大学 2020-01-31 CN disclosed
WO-2018048924-A1 GEL NETWORK HAIR TREATMENT COMPOSITIONS WITH REDUCED ODOR NOXELL CORPORATION (US) 2018-03-15 WO disclosed
CN-100491323-C Biaryloxymethylarenecarboxylic acids compound HOFFMANN LA ROCHE (CH) 2009-05-27 CN disclosed
EP-1663936-B1 BIARYLOXYMETHYLARENE-CARBOXYLIC ACIDS HOFFMANN LA ROCHE (CH) 2008-01-09 EP disclosed
US-20060287527-A1 Process for producing acrylic acid derivative NIPPON SODA CO., LTD. (JP) 2006-12-21 US disclosed
CN-1812956-A Biaryloxymethylarenecarboxylic acids as glycogen synthase activator HOFFMANN LA ROCHE (CH) 2006-08-02 CN disclosed
CN-1205171-C Process for producing 2-halomethylphenylacetic acid esters SAGAMI CHEM RES (JP) 2005-06-08 CN disclosed
CN-1186309-C Process for producing 3-isochromanone SAGAMI CHEM RES (JP) 2005-01-26 CN disclosed
CN-1566072-A Method for preparing 2-halomethyl phenylacetiate SAGAMI CHEM RES (JP) 2005-01-19 CN disclosed
CN-1168718-C Process for preparation of 2-(6-substituted pyrid-2-yloxymethyl) phenylacetate 2004-09-29 CN disclosed
US-20040152894-A1 Process for producing acrylic acid derivative NIPPON SODA CO. LTD (JP) 2004-08-05 US disclosed
CN-1105105-C Process for preparing 2- (pyridin-2-yloxymethyl) phenylacetates as intermediates in insecticides ZENECA LTD (GB) 2003-04-09 CN disclosed
CN-1328991-A Process for producing 2-halomethylphenylacetic acid esters SAGAMI CHEMICA RES CT (JP) 2002-01-02 CN disclosed
EP-1142857-A1 PROCESSES FOR PRODUCING ACRYLIC ACID DERIVATIVE NIPPON SODA CO., LTD. (JP) 2001-10-10 EP disclosed
CN-1198740-A Process for preparing 2- (pyridin-2-yloxymethyl) phenylacetates as intermediates in insecticides ZENECA LTD (GB) 1998-11-11 CN disclosed
CN-1193314-A Process for producing 2-halomethylphenylacetic acid esters SAGAMI CHEM RES (JP) 1998-09-16 CN disclosed
CN-1189155-A Process for preparation of 2-(6-substituted pyrid-2-yloxymethyl) phenylacetate ZENECA LTD (GB) 1998-07-29 CN disclosed
EP-0506794-A1 NOVEL VITAMIN D ANALOGUES. LEO PHARM PROD LTD (DK) 1992-10-07 EP disclosed
WO-1991009841-A1 NOVEL VITAMIN D ANALOGUES Leo Pharmaceutical Products Ltd. A/S (Løvens Kemiske Fabrik Produktionsaktieselskab) (DK) 1991-07-11 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 (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-20040152894-A1 Process for producing acrylic acid derivative OXGR1, GART, HAO2 KMT2A 938/4885ESR1 2243/4885ESR2 3302/4885
US-20060287527-A1 Process for producing acrylic acid derivative APEH, HAAO, ASNS KMT2A 696/4885ESR1 1321/4885ESR2 2741/4885

“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.