SCHEMBL29227828

SCHEMBL29227828

COc1cc2ccccc2c(C(N)=O)c1OC

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTSD P07339 1/20 0.48
ALDH1A1 P00352 5/20 0.47
KDM4E B2RXH2 4/20 0.47
HPGD P15428 3/20 0.47
NPSR1 Q6W5P4 2/20 0.47
PTGES O14684 1/20 0.46
ALOX5 P09917 1/20 0.46
KMT2A Q03164 3/20 0.44
MEN1 O00255 2/20 0.44
CYP1A2 P05177 1/20 0.43
GLA P06280 1/20 0.43
CYP2C19 P33261 1/20 0.43
HSD17B10 Q99714 1/20 0.43
ERN1 O75460 1/20 0.43
PDE1A P54750 1/20 0.43
PDE1B Q01064 1/20 0.43
PDE3B Q13370 1/20 0.43
PDE1C Q14123 1/20 0.43
PDE3A Q14432 1/20 0.43
TSHR P16473 2/20 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
SCHEMBL1671183 0.86 KDM4E (0.58) CTSDALDH1A1KDM4EHPGDNPSR1
SCHEMBL6604677 0.84 CTSD (0.48) CTSDALDH1A1KDM4EHPGDNPSR1
SCHEMBL5268571 0.83 ALDH1A1 (0.47) CTSDALDH1A1KDM4EHPGDNPSR1
SCHEMBL27568346 0.80 KDM4E (0.50) CTSDALDH1A1KDM4EHPGDNPSR1
SCHEMBL28819080 0.79 PARP1 (0.46) ALDH1A1KDM4EHPGDKMT2AMEN1
SCHEMBL2113634 0.79 MAPT (0.55) CTSDALDH1A1KDM4EHPGDKMT2A
SCHEMBL14134370 0.79 CTSD (0.46) CTSDALDH1A1KDM4EHPGDNPSR1
SCHEMBL7616763 0.76 KDM4E (0.54) CTSDALDH1A1KDM4EHPGDNPSR1
SCHEMBL27626385 0.76 CA12 (0.50) CTSDALDH1A1KDM4EHPGDNPSR1
SCHEMBL6604466 0.76 KDM4E (0.53) CTSDALDH1A1KDM4EHPGDNPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118126690-B Carbon nano tube plugging agent, preparation method and application thereof, and well control fluid 中国石油化工股份有限公司石油勘探开发研究院 2024-07-05 CN disclosed
CN-118240544-A Fracturing fluid for reservoir reformation and preparation method thereof 中国石油化工股份有限公司石油勘探开发研究院 2024-06-25 CN disclosed
CN-118240547-A Acid liquor for acidification transformation and preparation method thereof 中国石油化工股份有限公司石油勘探开发研究院 2024-06-25 CN disclosed
CN-118126690-A Carbon nano tube plugging agent, preparation method and application thereof, and well control fluid 中国石油化工股份有限公司石油勘探开发研究院 2024-06-04 CN disclosed