SCHEMBL6381502

SCHEMBL6381502

C=CCNCCc1ccc(N=Nc2ccccc2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 3/20 0.42
SIGMAR1 Q99720 5/20 0.41
MAPT P10636 2/20 0.41
GAA P10253 1/20 0.41
BCHE P06276 1/20 0.40
ALDH1A1 P00352 3/20 0.40
KDM4E B2RXH2 2/20 0.40
MEN1 O00255 1/20 0.40
LMNA P02545 1/20 0.40
HTT P42858 1/20 0.40
KMT2A Q03164 1/20 0.40
ADRB2 P07550 1/20 0.39
ADRB1 P08588 1/20 0.39
PRMT1 Q99873 1/20 0.39
CA12 O43570 1/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
CA4 P22748 1/20 0.37
NPC1 O15118 1/20 0.36
RAB9A P51151 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
SCHEMBL252240 0.84 KCNH2 (0.56) KCNH2SIGMAR1MAPTGAAALDH1A1
SCHEMBL6377313 0.83 DPP7 (0.44) MAPTALDH1A1KDM4EMEN1LMNA
Water SCHEMBL27458807 0.83 KCNH2 (0.55) KCNH2SIGMAR1MAPTGAAALDH1A1
Hydrochloric Acid SCHEMBL2236705 0.83 GAA (0.59) KCNH2SIGMAR1MAPTGAAALDH1A1
SCHEMBL8655738 0.83 KCNH2 (0.55) KCNH2SIGMAR1MAPTGAAALDH1A1
SCHEMBL11400974 0.78 SIGMAR1 (0.47) KCNH2SIGMAR1MAPTGAAALDH1A1
SCHEMBL23280869 0.78 ALDH1A1 (0.46) MAPTALDH1A1KDM4EMEN1LMNA
SCHEMBL6374209 0.74 OPRK1 (0.48) SIGMAR1MAPTBCHEALDH1A1KDM4E
SCHEMBL13278246 0.74 ALDH1A1 (0.63) MAPTALDH1A1KDM4EMEN1LMNA
SCHEMBL13278248 0.74 ALDH1A1 (0.63) MAPTALDH1A1KDM4EMEN1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050101690-A1 Dye for an intraocular lens and an intraocular lens using it CANON-STAAR CO. INC. 2005-05-12 US claimed
US-20050101690-A1 Dye for an intraocular lens and an intraocular lens using it CANON-STAAR CO. INC. 2005-05-12 US disclosed
US-6878792-B2 Dye for an intraocular lens and an intraocular lens using it CANON-STAAR CO. INC. (JP) 2005-04-12 US disclosed
US-20030078359-A1 Dye for an intraocular lens and an intraocular lens using it CANON-STAAR CO. INC. 2003-04-24 US disclosed
EP-1293541-A2 Intraocular lens and dye therefor Canon-Staar Co., Inc. (JP) 2003-03-19 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-20050101690-A1 Dye for an intraocular lens and an intraocular lens using it IK, CRYAA, INCENP KCNH2 227/4885SIGMAR1 3927/4885MAPT 247/4885

“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.