SCHEMBL6045244

SCHEMBL6045244

OCCC1CNCCN1CCCCN1c2ccccc2Oc2ccccc21

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 3/20 0.41
TAAR1 Q96RJ0 1/20 0.40
CA1 P00915 2/20 0.36
CA2 P00918 2/20 0.36
CA4 P22748 2/20 0.36
CA9 Q16790 2/20 0.36
SIGMAR1 Q99720 1/20 0.36
KDM1A O60341 1/20 0.35
TDP1 Q9NUW8 2/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
HDAC3 O15379 1/20 0.34
TUBB4A P04350 1/20 0.34
TUBB P07437 1/20 0.34
TUBA3C P0DPH7 1/20 0.34
HDAC4 P56524 1/20 0.34
TUBA1B P68363 1/20 0.34
TUBA4A P68366 1/20 0.34
TUBB4B P68371 1/20 0.34
TUBB3 Q13509 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
SCHEMBL6045308 0.91 PIM1 (0.56) PIM1TAAR1TDP1MEN1KMT2A
SCHEMBL6045312 0.89 PIM1 (0.56) PIM1TAAR1SIGMAR1TDP1MEN1
SCHEMBL9419643 0.79 CA1 (0.40) CA1CA2CA4CA9
SCHEMBL13305256 0.73 KDM1A (0.61) PIM1SIGMAR1KDM1ATDP1MEN1
SCHEMBL6045358 0.72 PIM1 (0.43) PIM1MEN1KMT2A
SCHEMBL366506 0.71 CA1 (0.42) TAAR1CA1CA2CA4CA9
SCHEMBL7494294 0.71 TAAR1 (0.46) TAAR1
SCHEMBL10385631 0.71 CA1 (0.39) TAAR1CA1CA2CA4CA9
SCHEMBL9419616 0.71 HTR1A (0.62) PIM1SIGMAR1KDM1ATDP1MEN1
SCHEMBL9419620 0.70 SIGMAR1 (0.45) PIM1CA1CA2CA4CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20060241108-A1 Substituted phenoxazines and acridones as inhibitors of AKT ST. JUDE CHILDREN'S RESEARCH HOSPITAL (US) 2006-10-26 US claimed
WO-2006094207-A2 SUBSTITUTED PHENOXAZINES AND ACRIDONES AS INHIBITORS OF AKT ST. JUDE CHILDREN'S RESEARCH HOSPITAL (US) 2006-09-08 WO claimed
US-20060241108-A1 Substituted phenoxazines and acridones as inhibitors of AKT ST. JUDE CHILDREN'S RESEARCH HOSPITAL (US) 2006-10-26 US disclosed
WO-2006094207-A2 SUBSTITUTED PHENOXAZINES AND ACRIDONES AS INHIBITORS OF AKT ST. JUDE CHILDREN'S RESEARCH HOSPITAL (US) 2006-09-08 WO 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-20060241108-A1 Substituted phenoxazines and acridones as inhibitors of AKT AKT1S1, AKT3, PIK3CA PIM1 572/4885TAAR1 2108/4885CA1 4687/4885

“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.