SCHEMBL4604088

SCHEMBL4604088

COC(=O)c1cc(Cc2ccccc2)ccc1N

nearest known ligand 0.85

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 9/20 0.85
GAA P10253 5/20 0.85
HSD17B10 Q99714 4/20 0.85
MAPT P10636 4/20 0.85
KDM4E B2RXH2 4/20 0.85
HPGD P15428 4/20 0.85
TSHR P16473 2/20 0.85
ALOX15 P16050 1/20 0.85
CDC25B P30305 1/20 0.58
CASP6 P55212 1/20 0.58
RCE1 Q9Y256 1/20 0.58
CFTR P13569 1/20 0.56
HNF4A P41235 1/20 0.50
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
LMNA P02545 2/20 0.47
POLB P06746 1/20 0.47
MPO P05164 1/20 0.46
GLA P06280 2/20 0.44
CASP1 P29466 1/20 0.44

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
SCHEMBL1809277 0.92 ALDH1A1 (1.00) ALDH1A1GAAHSD17B10MAPTKDM4E
SCHEMBL30041521 0.92 ALDH1A1 (1.00) ALDH1A1GAAHSD17B10MAPTKDM4E
SCHEMBL12846981 0.87 ALDH1A1 (0.82) ALDH1A1GAAHSD17B10MAPTKDM4E
SCHEMBL27851724 0.85 ALDH1A1 (0.75) ALDH1A1GAAHSD17B10MAPTKDM4E
SCHEMBL9129574 0.84 ALDH1A1 (0.72) ALDH1A1GAAHSD17B10MAPTKDM4E
SCHEMBL27851719 0.84 ALDH1A1 (0.59) ALDH1A1GAAHSD17B10MAPTKDM4E
SCHEMBL27642797 0.83 ALDH1A1 (0.70) ALDH1A1GAAHSD17B10MAPTKDM4E
SCHEMBL2131857 0.82 ALDH1A1 (0.86) ALDH1A1GAAHSD17B10MAPTKDM4E
SCHEMBL221403 0.82 ALDH1A1 (0.81) ALDH1A1GAAHSD17B10MAPTKDM4E
SCHEMBL17262500 0.82 KDM4E (0.56) ALDH1A1GAAHSD17B10MAPTKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113173885-A Method for synthesizing benzydamine hydrochloride impurity B 龙曦宁(上海)医药科技有限公司 2021-07-27 CN claimed
CN-113173885-A Method for synthesizing benzydamine hydrochloride impurity B 龙曦宁(上海)医药科技有限公司 2021-07-27 CN disclosed
CN-1914152-B New compounds, methods for their preparation and use thereof ACTIVE BIOTECH AB 2010-06-09 CN disclosed
EP-1720825-B1 ANTHRANILIC ACID DERIVATIVES, METHODS FOR THEIR PREPARATION AND USE AS DHODH INHIBITORS ACTIVE BIOTECH AB (SE) 2008-07-09 EP disclosed
CN-1914152-A New compounds, methods for their preparation and use thereof ACTIVE BIOTECH AB (SE) 2007-02-14 CN disclosed
EP-1720825-A1 NEW COMPOUNDS, METHODS FOR THEIR PREPARATION AND USE THEREOF Active Biotech AB (SE) 2006-11-15 EP disclosed
US-7074831-B2 Compounds, methods for their preparation and use thereof ACTIVE BIOTECH AB (SE) 2006-07-11 US disclosed
US-20050187297-A1 New compounds, methods for their preparation and use thereof ACTIVE BIOTECH AB (SE) 2005-08-25 US disclosed
WO-2005075410-A1 NEW COMPOUNDS, METHODS FOR THEIR PREPARATION AND USE THEREOF ACTIVE BIOTECH AB (SE) 2005-08-18 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 (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-20050187297-A1 New compounds, methods for their preparation and use thereof MALT1, TPMT, FUCA1 ALDH1A1 308/4885GAA 864/4885HSD17B10 783/4885

“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.