SCHEMBL1426474

SCHEMBL1426474

COC=C(C(=O)OC)c1ccccc1C

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 3/20 0.43
RAB9A P51151 3/20 0.43
HPGD P15428 2/20 0.42
ERCC5 P28715 1/20 0.41
FEN1 P39748 1/20 0.41
LMNA P02545 1/20 0.40
KMT2A Q03164 2/20 0.39
MEN1 O00255 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
KCNK3 O14649 1/20 0.39
POLB P06746 1/20 0.39
KCNK9 Q9NPC2 1/20 0.39
MYC P01106 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL1426471 1.00 NPC1 (0.43) NPC1RAB9AHPGDERCC5FEN1
SCHEMBL5998808 1.00 NPC1 (0.43) NPC1RAB9AHPGDERCC5FEN1
SCHEMBL9723735 0.86 NPC1 (0.45) NPC1RAB9AHPGDERCC5FEN1
SCHEMBL5998811 0.86 NPC1 (0.45) NPC1RAB9AHPGDERCC5FEN1
SCHEMBL10358883 0.85 ALDH1A1 (0.40) RAB9AHPGDLMNAL3MBTL1SMN1; SMN2
SCHEMBL10358881 0.85 ALDH1A1 (0.40) RAB9AHPGDLMNAL3MBTL1SMN1; SMN2
SCHEMBL1426456 0.84 NPC1 (0.44) NPC1RAB9AHPGDERCC5FEN1
SCHEMBL1426457 0.84 NPC1 (0.44) NPC1RAB9AHPGDERCC5FEN1
SCHEMBL8461319 0.84 NPC1 (0.44) NPC1RAB9AHPGDERCC5FEN1
SCHEMBL6265289 0.84 ERCC5 (0.46) NPC1RAB9AHPGDERCC5FEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6162945-A Process for preparing 2-(2-methylphenyl)-3-methoxyacrylic acid methylester BASF AKTIENGESELLSCHAFT (DE) 2000-12-19 US claimed
US-5898081-A Chemical process ZENECA LIMITED (GB) 1999-04-27 US claimed
EP-0656880-B1 CHEMICAL PROCESS ZENECA LTD (GB) 1997-10-15 EP claimed
US-9422254-B2 Methoxyacrylate-based fungicide and methods for preparing and using the same Central China Normal University (CN) 2016-08-23 US disclosed
CN-101906042-B Separation and purification method and device of alpha-o-methyl phenyl-beta-methoxyl methyl acrylate Zhejiang hetian chemical co ltd 2013-11-13 CN disclosed
CN-101906042-B Separation and purification method and device of alpha-o-methyl phenyl-beta-methoxyl methyl acrylate Zhejiang hetian chemical co ltd 2013-11-13 CN disclosed
EP-2301925-A1 A METHOXYL ACRYLIC ESTER FUNGICIDE, THE PREPARATION METHOD AND USES THEREOF Huazhong Normal University (CN) 2011-03-30 EP disclosed
CN-101906042-A Separation and purification method and device of alpha-o-methyl phenyl-beta-methoxyl methyl acrylate Zhejiang hetian chemical co ltd 2010-12-08 CN disclosed
CN-101906042-A Separation and purification method and device of alpha-o-methyl phenyl-beta-methoxyl methyl acrylate Zhejiang hetian chemical co ltd 2010-12-08 CN disclosed
US-20100292285-A1 METHOXYACRYLATE-BASED FUNGICIDE AND METHODS FOR PREPARING AND USING THE SAME Central China Normal University (CN) 2010-11-18 US disclosed
US-20060287527-A1 Process for producing acrylic acid derivative NIPPON SODA CO., LTD. (JP) 2006-12-21 US disclosed
EP-0331966-A1 Substituted acrylic-acid esters BAYER AG (DE) 1989-09-13 EP disclosed
US-4822908-A Substituted acrylates and fungicides containing same BASF AKTIENGESELLSCHAFT (DE) 1989-04-18 US disclosed
US-4782177-A AGRICULTURE BASF AKTIENGESELLSCHAFT (DE) 1988-11-01 US disclosed
EP-0278595-A2 Fungicides ZENECA LIMITED (GB) 1988-08-17 EP disclosed
US-4723034-A Stilbene derivatives, and fungicides which contain these compounds BASF AKTIENGESELLSCHAFT (DE) 1988-02-02 US disclosed
EP-0251082-A2 Substituted acrylic acid esters and fungicides containing these compounds BASF Aktiengesellschaft (DE) 1988-01-07 EP disclosed
EP-0229974-A1 Acrylic acid derivatives and fungicides containing them BASF Aktiengesellschaft (DE) 1987-07-29 EP disclosed
EP-0226917-A1 Acrylic acid esters and fungicides containing these compounds BASF Aktiengesellschaft (DE) 1987-07-01 EP disclosed
EP-0203606-A2 Derivatives of stilbene and fungicides containing these compounds BASF Aktiengesellschaft (DE) 1986-12-03 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 (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-20100292285-A1 METHOXYACRYLATE-BASED FUNGICIDE AND METHODS FOR PREPARING AND USING THE SAME SPOUT1, CDY1; CDY1B, MANBA NPC1 2932/4885RAB9A 640/4885HPGD 4817/4885
US-20060287527-A1 Process for producing acrylic acid derivative APEH, HAAO, ASNS NPC1 3447/4885RAB9A 715/4885HPGD 1416/4885

“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.