SCHEMBL28600111

SCHEMBL28600111

COc1ccc(N(c2ccc(OC)cc2)c2ccc(OB(O)O)cc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 4/20 0.52
CA2 P00918 4/20 0.52
ENPP2 Q13822 2/20 0.52
CA7 P43166 2/20 0.44
CA9 Q16790 2/20 0.44
CA12 O43570 1/20 0.44
CA14 Q9ULX7 1/20 0.44
SLC2A1 P11166 1/20 0.40
HDAC6 Q9UBN7 1/20 0.40
NR1I2 O75469 1/20 0.39
ESR2 Q92731 2/20 0.39
MAPT P10636 2/20 0.39
NPC1 O15118 1/20 0.39
TP53 P04637 1/20 0.39
RAB9A P51151 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
NOX1 Q9Y5S8 1/20 0.39
ACHE P22303 1/20 0.38
LTA4H P09960 1/20 0.38
CES2 O00748 1/20 0.38

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
SCHEMBL351810 0.87 CA1 (0.58) CA1CA2ENPP2CA7CA9
SCHEMBL17421190 0.84 CA2 (0.41) CA1CA2ENPP2MAPTTP53
SCHEMBL6233100 0.82 CA1 (0.65) CA1CA2ENPP2CA7CA9
SCHEMBL1573622 0.82 CA1 (0.65) CA1CA2ENPP2CA7CA9
SCHEMBL16426511 0.82 ALDH1A1 (0.45) CA1CA2ENPP2CA7CA14
SCHEMBL16179596 0.82 CA2 (0.79) CA1CA2ENPP2CA7CA9
SCHEMBL28085472 0.81 LTA4H (0.58) CA1CA2ENPP2CA7CA9
Boric Acid SCHEMBL28347429 0.80 ENPP2 (0.52) CA1CA2ENPP2CA7CA9
Boric Acid SCHEMBL28458904 0.80 ENPP2 (0.52) CA1CA2ENPP2CA7CA9
SCHEMBL31575672 0.79 RAB9A (0.40) CA1CA2CA9MAPTNPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119978012-A Activatable bio-biomimetic probe with aggregation-induced emission and application 华中科技大学同济医学院附属协和医院 2025-05-13 CN claimed
CN-119569676-A Nile red derivative with photodynamic-photothermal properties and preparation and application thereof 广东省第二人民医院(广东省卫生应急医院) 2025-03-07 CN claimed
CN-118949029-A Water-soluble type I photosensitizer and preparation method and application thereof 兰州大学 2024-11-15 CN claimed
CN-118791473-A Triphenylamine derivative and preparation method thereof, pH response color-changing fiber and preparation method thereof 武汉纺织大学 2024-10-18 CN claimed
CN-118459455-A Aggregation-induced emission photosensitizer capable of enhancing active oxygen capability by using triazole as well as preparation method and application thereof 汕头大学医学院 2024-08-09 CN claimed
CN-121800774-A ICT-based polarity-sensitive fluorescent probe and preparation method and application thereof 安徽大学 2026-04-07 CN disclosed
CN-121378133-A Type I and type II naphthalimide photosensitizer as well as preparation method and application thereof 东华大学 2026-01-23 CN disclosed
CN-121085907-A Trithiophene type fluorescent probe for detecting total polar substances of edible oil, preparation method and application 南京林业大学 2025-12-09 CN disclosed
CN-118791473-B Triphenylamine derivative and preparation method thereof, pH response color-changing fiber and preparation method thereof 武汉纺织大学 2025-09-16 CN disclosed
CN-119978012-A Activatable bio-biomimetic probe with aggregation-induced emission and application 华中科技大学同济医学院附属协和医院 2025-05-13 CN disclosed
CN-119569676-A Nile red derivative with photodynamic-photothermal properties and preparation and application thereof 广东省第二人民医院(广东省卫生应急医院) 2025-03-07 CN disclosed
CN-118949029-A Water-soluble type I photosensitizer and preparation method and application thereof 兰州大学 2024-11-15 CN disclosed
CN-118791473-A Triphenylamine derivative and preparation method thereof, pH response color-changing fiber and preparation method thereof 武汉纺织大学 2024-10-18 CN disclosed
CN-118791473-A Triphenylamine derivative and preparation method thereof, pH response color-changing fiber and preparation method thereof 武汉纺织大学 2024-10-18 CN disclosed
CN-118459455-A Aggregation-induced emission photosensitizer capable of enhancing active oxygen capability by using triazole as well as preparation method and application thereof 汕头大学医学院 2024-08-09 CN disclosed
CN-115850247-B Asymmetric thermal activation delay fluorescent material based on triazine and fluorene unit derivatives, and preparation and application thereof 宁波大学 2024-07-19 CN disclosed
CN-113150011-A Diazosulfide dipyrrolodithiophene-based interface material and preparation method and application thereof 中国科学院化学研究所 2021-07-23 CN disclosed