SCHEMBL28392792

SCHEMBL28392792

CCOc1cc(Br)ncc1O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.42
▸ HPGD P15428 5/20 0.41
▸ KDM4E B2RXH2 4/20 0.41
▸ CYP3A4 P08684 2/20 0.41
▸ CYP1A2 P05177 1/20 0.41
▸ GAA P10253 1/20 0.41
▸ CYP2C9 P11712 1/20 0.41
▸ CYP2C19 P33261 1/20 0.41
▸ KMT2A Q03164 2/20 0.41
▸ MEN1 O00255 1/20 0.41
▸ HSD17B10 Q99714 3/20 0.40
▸ TSHR P16473 3/20 0.40
▸ SMN1; SMN2 Q16637 2/20 0.38
▸ ALOX15 P16050 1/20 0.38
▸ APOBEC3G Q9HC16 1/20 0.38
▸ TOP2A P11388 1/20 0.37
▸ LMNA P02545 1/20 0.37
▸ ABL1 P00519 1/20 0.36
▸ ABCB1 P08183 1/20 0.36
▸ BCR P11274 1/20 0.36

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
SCHEMBL28888359 0.80 MAOB (0.42) ALDH1A1HPGDCYP3A4KMT2AMEN1
SCHEMBL25004559 0.78 HPGD (0.39) HPGDKDM4EHSD17B10TSHRSMN1; SMN2
SCHEMBL22978591 0.77 SMN1; SMN2 (0.38) ALDH1A1HPGDKDM4EGAAHSD17B10
SCHEMBL26646826 0.77 HSD17B10 (0.48) ALDH1A1HPGDKDM4EGAAKMT2A
SCHEMBL19346801 0.74 HPGD (0.39) ALDH1A1HPGDKDM4EHSD17B10TSHR
SCHEMBL31274754 0.74 HPGD (0.39) ALDH1A1HPGDKDM4EHSD17B10TSHR
SCHEMBL9714219 0.74 ALDH1A1 (0.53) ALDH1A1HPGDKDM4ECYP3A4CYP1A2
SCHEMBL27082366 0.74 TSHR (0.52) ALDH1A1HPGDKDM4ECYP3A4CYP1A2
SCHEMBL30755821 0.73 HSD17B10 (0.44) ALDH1A1HPGDKDM4EGAAKMT2A
SCHEMBL30427170 0.73 TSHR (0.60) ALDH1A1HPGDKDM4ECYP3A4CYP1A2

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-106573005-B Process for preparing 4-alkoxy-3-hydroxypicolinic acid 美国陶氏益农公司 2020-05-29 — — CN disclosed
CN-106659724-B Process for preparing 4-alkoxy-3-hydroxypicolinic acid 美国陶氏益农公司 2020-04-28 — — CN disclosed
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