SCHEMBL17417856

SCHEMBL17417856

COc1ccc([B-](c2ccccc2)(c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA4 P22748 1/20 0.59
LTA4H P09960 2/20 0.56
CA1 P00915 2/20 0.52
CA2 P00918 2/20 0.52
CA7 P43166 2/20 0.52
CA9 Q16790 2/20 0.52
CA12 O43570 1/20 0.52
CA14 Q9ULX7 1/20 0.52
TRPA1 O75762 1/20 0.50
ALDH1A1 P00352 2/20 0.49
LMNA P02545 2/20 0.49
NPSR1 Q6W5P4 2/20 0.49
HSD17B10 Q99714 1/20 0.49
TDP1 Q9NUW8 2/20 0.47
NPC1 O15118 1/20 0.47
RAB9A P51151 1/20 0.47
KDM4E B2RXH2 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
CES2 O00748 1/20 0.47
CES1 P23141 1/20 0.47

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
SCHEMBL1451503 0.90 CA1 (0.65) CA4LTA4HCA1CA2CA7
SCHEMBL9930633 0.86 CA4 (0.48) CA4LTA4HCA1CA2CA7
Tetraphenylphosphonium SCHEMBL17271410 0.86 CA4 (0.48) CA4LTA4HCA1CA2CA7
SCHEMBL3139194 0.84 CA4 (0.46) CA4LTA4HCA1CA2CA7
SCHEMBL3143783 0.84 CA4 (0.46) CA4LTA4HCA1CA2CA7
Tetramethylammonium Ion SCHEMBL3618056 0.83 CA1 (0.55) CA4LTA4HCA1CA2CA7
SCHEMBL20841983 0.78 NFE2L2 (0.56) ALDH1A1LMNAKDM4EL3MBTL1CYP1A2
SCHEMBL291776 0.77 CA4 (0.68) CA4LTA4HCA1CA2CA7
SCHEMBL9152375 0.77 CA4 (0.68) CA4LTA4HCA1CA2CA7
SCHEMBL17283658 0.77 CA4 (0.68) CA4LTA4HCA1CA2CA7

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
EP-2980180-A1 PHOTOBASE GENERATOR San-Apro Ltd. (JP) 2016-02-03 EP disclosed
US-20160009737-A1 PHOTOBASE GENERATOR SAN-APRO LTD. (JP) 2016-01-14 US 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-20160009737-A1 PHOTOBASE GENERATOR PSMC6, ARCN1, CRY1 CA4 1471/4885LTA4H 2432/4885CA1 666/4885

“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.