SCHEMBL24253152

SCHEMBL24253152

COc1cc(C(C)=O)cc(SC#N)c1OC

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 3/20 0.49
▸ PDE4A P27815 2/20 0.43
▸ PDE4B Q07343 2/20 0.43
▸ PDE4C Q08493 2/20 0.43
▸ PDE4D Q08499 2/20 0.43
▸ TPMT P51580 1/20 0.41
▸ ALDH1A1 P00352 4/20 0.40
▸ MAPT P10636 4/20 0.40
▸ HTT P42858 2/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ POLB P06746 2/20 0.39
▸ GFER P55789 1/20 0.39
▸ TSHR P16473 1/20 0.39
▸ APOBEC3A P31941 1/20 0.39
▸ APOBEC3G Q9HC16 1/20 0.39
▸ TUBB4A P04350 1/20 0.39
▸ TUBB P07437 1/20 0.39
▸ TUBA3C P0DPH7 1/20 0.39
▸ TUBA1B P68363 1/20 0.39
▸ TUBA4A P68366 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
SCHEMBL24253153 0.81 LMNA (0.55) LMNATPMTALDH1A1MAPTHTT
SCHEMBL31059015 0.81 LMNA (0.55) LMNATPMTALDH1A1MAPTHTT
SCHEMBL7939412 0.80 ALDH1A1 (0.48) LMNATPMTALDH1A1MAPTKMT2A
SCHEMBL290542 0.78 LMNA (0.69) LMNATPMTALDH1A1MAPTHTT
SCHEMBL7368999 0.76 LMNA (0.53) LMNAPDE4APDE4BPDE4CPDE4D
Hydrochloric Acid SCHEMBL29142671 0.76 LMNA (0.67) LMNATPMTALDH1A1MAPTHTT
SCHEMBL1928259 0.73 LMNA (0.62) LMNATPMTALDH1A1MAPTHTT
SCHEMBL31059030 0.73 LMNA (0.49) LMNAPDE4APDE4BPDE4CPDE4D
SCHEMBL31059026 0.73 LMNA (0.49) LMNAPDE4APDE4BPDE4CPDE4D
Chloroform SCHEMBL7815652 0.72 LMNA (0.60) LMNATPMTALDH1A1MAPTHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022033612-A1 7-(3,4-DIMETHOXY-5-SELENOMETHYLPHENYL)-PYRROLO[2,3-D]PYRIMIDINE AND USE THEREOF 广东省科学院动物研究所 2022-02-17 — — WO disclosed
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