SCHEMBL3786835

SCHEMBL3786835

Cc1cc(N)cc(B(O)O)c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.57
TSHR P16473 1/20 0.57
KDM4E B2RXH2 2/20 0.46
ENPP2 Q13822 1/20 0.46
CA2 P00918 1/20 0.42
LPL P06858 1/20 0.42
LIPG Q9Y5X9 1/20 0.42
ACHE P22303 2/20 0.35
PRSS1 P07477 1/20 0.34
PRSS2 P07478 1/20 0.34
C1S P09871 1/20 0.34
PRSS3 P35030 1/20 0.34
LMNA P02545 1/20 0.33
GAA P10253 1/20 0.33
MAPT P10636 1/20 0.33
ORAI1 Q96D31 1/20 0.32
ORAI2 Q96SN7 1/20 0.32
ORAI3 Q9BRQ5 1/20 0.32
TRPV6 Q9H1D0 1/20 0.32
NOS2 P35228 2/20 0.31

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
SCHEMBL364635 0.87 CA2 (0.52) ALDH1A1TSHRKDM4EENPP2CA2
Ammonia Solution, Strong SCHEMBL28219615 0.85 LPL (0.50) ALDH1A1TSHRKDM4EENPP2CA2
SCHEMBL8509685 0.85 LPL (0.50) ALDH1A1TSHRKDM4EENPP2CA2
Boric Acid SCHEMBL29088799 0.82 ALDH1A1 (0.75) ALDH1A1TSHRKDM4EACHEPRSS1
SCHEMBL7657848 0.82 CA2 (0.52) ALDH1A1TSHRENPP2CA2LPL
Boric Acid SCHEMBL27960854 0.82 ALDH1A1 (0.75) ALDH1A1TSHRKDM4EACHEPRSS1
SCHEMBL190209 0.82 ENPP2 (0.56) ALDH1A1TSHRKDM4EENPP2CA2
SCHEMBL33318 0.76
SCHEMBL15270190 0.73 ALDH1A1 (0.57) ALDH1A1ENPP2CA2LPLLIPG
SCHEMBL3789580 0.73 ENPP2 (0.48) ALDH1A1KDM4EENPP2CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119798106-A Diamine monomer, polyimide, preparation method and application thereof 中山大学 2025-04-11 CN disclosed
CN-119620537-A Photosensitive polyimide photoresist and preparation method thereof 中山大学 2025-03-14 CN disclosed
CN-118515699-A Hirsutine alkaloid boric acid derivative and preparation method and application thereof 中国海洋大学 2024-08-20 CN disclosed
CN-116840332-A Selective detection method of non-diagnosis and treatment purpose isomer glucose 中国科学院兰州化学物理研究所 2023-10-03 CN disclosed
US-20100087680-A1 METHOD FOR PRODUCING BIARYL COMPOUND SUMITOMO CHEMICAL COMPANY LIMITED (JP) 2010-04-08 US disclosed
EP-1914221-A1 PROCESS FOR PRODUCING BIARYL COMPOUND Sumitomo Chemical Company, Limited (JP) 2008-04-23 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20100087680-A1 METHOD FOR PRODUCING BIARYL COMPOUND NISCH, BLVRB, BBOX1 ALDH1A1 4339/4885TSHR 1688/4885KDM4E 2606/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.