SCHEMBL28336403

SCHEMBL28336403

CC[n+]1ccccc1C(=O)OC

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.42
ALDH1A1 P00352 4/20 0.41
KDM4E B2RXH2 4/20 0.41
KMT2A Q03164 3/20 0.41
MEN1 O00255 1/20 0.41
USP2 O75604 1/20 0.41
APOBEC3A P31941 1/20 0.41
KEAP1 Q14145 1/20 0.41
NFE2L2 Q16236 1/20 0.41
APOBEC3G Q9HC16 1/20 0.41
LMNA P02545 2/20 0.39
CFTR P13569 1/20 0.38
HSD17B10 Q99714 1/20 0.38
RAB9A P51151 2/20 0.37
GAA P10253 1/20 0.37
CA12 O43570 1/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
CA7 P43166 1/20 0.37
CA9 Q16790 1/20 0.37

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
SCHEMBL28333934 0.86 TSHR (0.40) TSHRALDH1A1KDM4EKMT2AMEN1
SCHEMBL28336498 0.83 SMN1; SMN2 (0.40) TSHRALDH1A1KDM4EKMT2AMEN1
SCHEMBL1724143 0.79 CYP2D6 (0.41) TSHRALDH1A1KDM4EKMT2AMEN1
SCHEMBL28336516 0.79 CYP2D6 (0.41) TSHRALDH1A1KDM4EKMT2AMEN1
Bromide SCHEMBL1712146 0.78 CYP2D6 (0.40) ALDH1A1KDM4EKMT2AMEN1USP2
Hydrochloric Acid SCHEMBL28336408 0.78 CYP2D6 (0.40) TSHRALDH1A1KDM4EKMT2AMEN1
SCHEMBL8867815 0.78 CYP2D6 (0.37) ALDH1A1KDM4EKMT2AMEN1USP2
Hydrochloric Acid SCHEMBL1712716 0.78 CYP2D6 (0.40) ALDH1A1KDM4EKMT2AMEN1USP2
SCHEMBL25811944 0.76 TSHR (0.47) TSHRALDH1A1KDM4EKMT2AAPOBEC3A
Acetic Acid SCHEMBL1712859 0.75 CYP2D6 (0.38) ALDH1A1KDM4EKMT2AMEN1USP2

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-116103711-A Forward and reverse pulse electrolytic nickel-phosphorus alloy solution, preparation method, electroplating method and nickel-phosphorus alloy coating 安徽智备工业科技有限公司 2023-05-12 CN claimed
CN-106661735-B Palladium plating solution and palladium coating film obtained using the same 日本高纯度化学株式会社 2019-12-10 CN claimed
CN-116103711-A Forward and reverse pulse electrolytic nickel-phosphorus alloy solution, preparation method, electroplating method and nickel-phosphorus alloy coating 安徽智备工业科技有限公司 2023-05-12 CN disclosed
CN-106661735-B Palladium plating solution and palladium coating film obtained using the same 日本高纯度化学株式会社 2019-12-10 CN disclosed