SCHEMBL11765374

SCHEMBL11765374

O=C1CCC(=O)N1Oc1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ ALOX12 P18054 1/20 0.55
▸ PARL Q9H300 4/20 0.52
▸ ALDH1A1 P00352 2/20 0.42
▸ GFER P55789 1/20 0.42
▸ KMT2A Q03164 4/20 0.40
▸ SMN1; SMN2 Q16637 3/20 0.40
▸ MAPK1 P28482 1/20 0.39
▸ CA1 P00915 1/20 0.37
▸ CA2 P00918 1/20 0.37
▸ CA9 Q16790 1/20 0.37
▸ TSHR P16473 2/20 0.36
▸ LTA4H P09960 1/20 0.36
▸ HPGD P15428 2/20 0.36
▸ POLB P06746 1/20 0.35
▸ PLA2G7 Q13093 1/20 0.35
▸ PLCG1 P19174 1/20 0.35
▸ HSD17B10 Q99714 1/20 0.35

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
SCHEMBL8473466 0.76 ALOX12 (0.41) ALOX12PARLALDH1A1GFERKMT2A
SCHEMBL22974925 0.74 ALOX12 (0.47) ALOX12PARLALDH1A1GFERKMT2A
SCHEMBL22974934 0.74 ALOX12 (0.47) ALOX12PARLALDH1A1GFERKMT2A
SCHEMBL20248861 0.74 ALOX12 (0.70) ALOX12PARLALDH1A1GFERKMT2A
SCHEMBL22974947 0.74 ALOX12 (0.47) ALOX12PARLALDH1A1GFERKMT2A
SCHEMBL3804000 0.74 GSK3A (0.46) ALOX12PARLALDH1A1KMT2ATSHR
SCHEMBL436166 0.73 ALDH1A1 (0.50) ALDH1A1KMT2ASMN1; SMN2CA9HPGD
SCHEMBL31703779 0.73 ALDH1A1 (0.50) ALDH1A1KMT2ASMN1; SMN2CA9HPGD
SCHEMBL19341896 0.72 ALOX12 (0.46) ALOX12PARLALDH1A1GFERKMT2A
SCHEMBL16684237 0.72 ALOX12 (0.46) ALOX12PARLALDH1A1GFERKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112604004-B Anti-human EGFR antibody drug conjugate and preparation method and application thereof 中国医学科学院医药生物技术研究所 2022-05-10 — — CN disclosed
US-4026798-A PROLONGING USE FMC CORPORATION (US) 1977-05-31 — — US disclosed
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