SCHEMBL5570988

SCHEMBL5570988

OCNNc1ccccc1O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.42
KMT2A Q03164 6/20 0.42
MEN1 O00255 5/20 0.42
KDM4E B2RXH2 3/20 0.42
ALDH1A1 P00352 3/20 0.42
THRB P10828 1/20 0.42
ALOX12 P18054 1/20 0.42
CA12 O43570 2/20 0.42
CA2 P00918 2/20 0.42
CA9 Q16790 1/20 0.42
GAA P10253 5/20 0.39
NPC1 O15118 4/20 0.39
HTT P42858 4/20 0.39
LMNA P02545 3/20 0.39
TP53 P04637 2/20 0.39
RAB9A P51151 3/20 0.39
RECQL P46063 2/20 0.39
HIF1A Q16665 2/20 0.39
TDP1 Q9NUW8 2/20 0.39
GMNN O75496 1/20 0.39

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
SCHEMBL11648181 0.80 NPC1 (0.53) MAPTKMT2AMEN1KDM4EALDH1A1
SCHEMBL14382198 0.77 IDO1 (0.44) MAPTKMT2AMEN1KDM4EALDH1A1
SCHEMBL12313401 0.76 MAPT (0.55) MAPTKMT2AMEN1KDM4EALDH1A1
SCHEMBL28469430 0.72 NAAA (0.47) MAPTKMT2AMEN1ALDH1A1CA12
SCHEMBL5792178 0.71 NPC1 (0.43) MAPTKMT2AMEN1KDM4EALDH1A1
SCHEMBL7811923 0.71 MAPT (0.43) MAPTKMT2AMEN1KDM4EALDH1A1
SCHEMBL22169178 0.70 ALDH1A1 (0.57) MAPTKMT2AMEN1KDM4EALDH1A1
SCHEMBL10955276 0.70 KDM1A (0.59) MAPTKMT2AMEN1KDM4EALDH1A1
SCHEMBL304891 0.69 CXCR2 (0.54) MAPTKMT2AMEN1KDM4EALDH1A1
SCHEMBL16763415 0.69 ALDH1A1 (0.55) MAPTALDH1A1ALOX12GAALMNA

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
US-7258702-B2 Yellow cationic dyes for dyeing of organic material CIBA SPECIALTY CHEMICALS CORPORATION (US) 2007-08-21 US disclosed
US-20050000034-A1 Yellow cationic dyes for dyeing of organic material CIBA SPECIALTY CHEMICALS CORPORATION 2005-01-06 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-20050000034-A1 Yellow cationic dyes for dyeing of organic material KRT18, PYCR1, CYC1 MAPT 955/4885KMT2A 1389/4885MEN1 2050/4885

“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.