SCHEMBL20060550

SCHEMBL20060550

CCCCCCCC[B-](c1ccc(Cl)cc1)(c1ccc(Cl)cc1)c1ccc(Cl)cc1

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.42
KCNH2 Q12809 13/20 0.41
KDM4E B2RXH2 1/20 0.40
GAA P10253 1/20 0.40
HDAC3 O15379 1/20 0.34
HDAC1 Q13547 1/20 0.34
HDAC2 Q92769 1/20 0.34
ALDH1A1 P00352 1/20 0.34
HPGD P15428 1/20 0.34
POLB P06746 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
LMNA P02545 1/20 0.34

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
SCHEMBL6716885 1.00 SMN1; SMN2 (0.42) SMN1; SMN2KCNH2KDM4EGAAHDAC3
Tetramethylammonium Ion SCHEMBL1130159 0.94 KCNH2 (0.41) SMN1; SMN2KCNH2KDM4EGAA
SCHEMBL8757415 0.92 SMN1; SMN2 (0.40) SMN1; SMN2KCNH2KDM4EGAAHDAC3
Tetrabuthylammonium SCHEMBL1130800 0.91 KCNH2 (0.50) SMN1; SMN2KCNH2KDM4EGAAALDH1A1
Biphenyl SCHEMBL7784630 0.90 CYP1A2 (0.44) SMN1; SMN2KCNH2KDM4EGAA
SCHEMBL1131201 0.86 SMN1; SMN2 (0.36) SMN1; SMN2KCNH2KDM4EGAAALDH1A1
SCHEMBL1130143 0.86 KCNH2 (0.33) SMN1; SMN2KCNH2KDM4EGAA
SCHEMBL1130325 0.82 DNM1 (0.47) SMN1; SMN2KCNH2KDM4EALDH1A1
SCHEMBL8571110 0.82 HTT (0.44) KCNH2ALDH1A1HPGDL3MBTL1
SCHEMBL8574920 0.82 HTT (0.44) KCNH2ALDH1A1HPGDL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10001703-B2 Photopolymer formulation for production of holographic media comprising borates with low TG COVESTRO DEUTSCHLAND AG (DE) 2018-06-19 US disclosed
US-10001703-B2 Photopolymer formulation for production of holographic media comprising borates with low TG COVESTRO DEUTSCHLAND AG (DE) 2018-06-19 US disclosed
EP-3058423-B1 PHOTOPOLYMER FORMULATION FOR PRODUCING HOLOGRAPHIC MEDIA WITH LOW TG BORATES COVESTRO DEUTSCHLAND AG (DE) 2018-04-18 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-10001703-B2 Photopolymer formulation for production of holographic media comprising borates with low TG PTGIS, TST, MACF1 SMN1; SMN2 4704/4885KCNH2 3488/4885KDM4E 1218/4885

“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.