SCHEMBL4870015

SCHEMBL4870015

Cc1c[n+](C)c(/N=N/c2c(C)n(C)c3ccccc23)s1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.39
TSHR P16473 1/20 0.39
ALDH1A1 P00352 6/20 0.36
MAPT P10636 3/20 0.36
TDP1 Q9NUW8 2/20 0.36
GAA P10253 2/20 0.35
HPGD P15428 2/20 0.35
KDM4E B2RXH2 2/20 0.35
GLA P06280 1/20 0.35
CYP2C19 P33261 1/20 0.35
HTT P42858 1/20 0.35
HSD17B10 Q99714 1/20 0.35
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA9 Q16790 1/20 0.35
GPR3 P46089 1/20 0.35
NPSR1 Q6W5P4 2/20 0.35
ADORA3 P0DMS8 1/20 0.34
CHRM1 P11229 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
SCHEMBL4870021 1.00 KMT2A (0.39) KMT2ATSHRALDH1A1MAPTTDP1
Hydrochloric Acid SCHEMBL4872332 0.99 KMT2A (0.39) KMT2ATSHRALDH1A1MAPTTDP1
Hydrochloric Acid SCHEMBL4872335 0.99 KMT2A (0.39) KMT2ATSHRALDH1A1MAPTTDP1
Bromide SCHEMBL4869140 0.99 KMT2A (0.39) KMT2ATSHRALDH1A1MAPTTDP1
Bromide SCHEMBL4873694 0.99 KMT2A (0.39) KMT2ATSHRALDH1A1MAPTTDP1
SCHEMBL4875526 0.90 CA12 (0.39) KMT2ATSHRALDH1A1MAPTTDP1
SCHEMBL4874728 0.87 KMT2A (0.38) KMT2ATSHRALDH1A1MAPTTDP1
SCHEMBL4874732 0.87 KMT2A (0.38) KMT2ATSHRALDH1A1MAPTTDP1
SCHEMBL5171973 0.86 KMT2A (0.37) KMT2ATSHRALDH1A1MAPTTDP1
Hydrochloric Acid SCHEMBL4869125 0.86 KMT2A (0.37) KMT2ATSHRALDH1A1MAPTTDP1

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-7431741-B2 Brightening colorant with indolythiazolium dyes WELLA AG (DE) 2008-10-07 US claimed
US-20070180631-A1 Brightening colorant with indolythiazolium dyes Wella GmbH (DE) 2007-08-09 US claimed
EP-1730239-B1 LIGHTENING COLORANT CONTAINING INDOLYL THIAZOLIUM AZO DYES WELLA AG (DE) 2007-05-02 EP claimed

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-20070180631-A1 Brightening colorant with indolythiazolium dyes KRT18, TUBB1, IK KMT2A 1177/4885TSHR 3545/4885ALDH1A1 89/4885

“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.