SCHEMBL4903259

SCHEMBL4903259

[PbH]N1CCc2ccccc21

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.54
MEN1 O00255 3/20 0.54
KMT2A Q03164 3/20 0.54
USP2 O75604 1/20 0.54
CDK4 P11802 1/20 0.54
ALOX15 P16050 1/20 0.54
CCND1 P24385 1/20 0.54
SIGMAR1 Q99720 2/20 0.50
NOTUM Q6P988 1/20 0.47
TSHR P16473 2/20 0.46
HPGD P15428 1/20 0.44
ROCK1 Q13464 1/20 0.43
MAPT P10636 3/20 0.43
KDM4E B2RXH2 2/20 0.43
LMNA P02545 2/20 0.43
PTK2B Q14289 1/20 0.43
ESR2 Q92731 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.42
POLB P06746 1/20 0.42
TDP1 Q9NUW8 1/20 0.42

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
SCHEMBL1870741 0.73 ALDH1A1 (0.56) ALDH1A1MEN1KMT2AUSP2CDK4
SCHEMBL9215081 0.71 MEN1 (0.54) ALDH1A1MEN1KMT2AUSP2CDK4
SCHEMBL112247 0.71 MEN1 (0.54) ALDH1A1MEN1KMT2AUSP2CDK4
SCHEMBL7319715 0.71 ALDH1A1 (0.54) ALDH1A1MEN1KMT2AUSP2CDK4
SCHEMBL142091 0.71 ALDH1A1 (0.59) ALDH1A1MEN1KMT2AUSP2CDK4
SCHEMBL14269005 0.71 ALDH1A1 (0.54) ALDH1A1MEN1KMT2AUSP2CDK4
SCHEMBL1408362 0.71 SIGMAR1 (0.55) ALDH1A1MEN1KMT2AUSP2CDK4
SCHEMBL1268068 0.71 MEN1 (0.54) ALDH1A1MEN1KMT2AUSP2CDK4
SCHEMBL142090 0.71 ALDH1A1 (0.54) ALDH1A1MEN1KMT2AUSP2CDK4
SCHEMBL982352 0.71 ALDH1A1 (0.54) ALDH1A1MEN1KMT2AUSP2CDK4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080104774-A1 AMMONIA-FREE OXIDATION DYE FOR DYEING KERATIN FIBERS WITH ATMOSPHERIC OSYGEN SERVING AS THE SOLE OXIDIZING AGENT HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2008-05-08 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-20080104774-A1 AMMONIA-FREE OXIDATION DYE FOR DYEING KERATIN FIBERS WITH ATMOSPHERIC OSYGEN SERVING AS THE SOLE OXIDIZING AGENT KRT18, AKR1C4, OAT ALDH1A1 475/4885MEN1 2848/4885KMT2A 737/4885

“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.