SCHEMBL24205686

SCHEMBL24205686

CC(C)(C)c1ccc2nc(-c3ccc(N(c4ccc(-c5nc6ccccc6o5)cc4)c4ccc(-c5nc6ccccc6o5)cc4)cc3)oc2c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 10/20 0.51
RAB9A P51151 8/20 0.51
GFER P55789 2/20 0.51
HDAC6 Q9UBN7 2/20 0.50
MEN1 O00255 1/20 0.49
KMT2A Q03164 1/20 0.49
ATM Q13315 1/20 0.49
TP53 P04637 4/20 0.48
MAPT P10636 4/20 0.47
RXFP1 Q9HBX9 1/20 0.47
SMN1; SMN2 Q16637 7/20 0.46
KDM4E B2RXH2 6/20 0.46
ALDH1A1 P00352 6/20 0.46
HPGD P15428 6/20 0.46
HCRTR1 O43613 2/20 0.46
NFKB1 P19838 2/20 0.46
STAT1 P42224 2/20 0.46
NFKB2 Q00653 2/20 0.46
RELA Q04206 2/20 0.46
HSD17B10 Q99714 3/20 0.46

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
SCHEMBL24205726 1.00 NPC1 (0.51) NPC1RAB9AGFERHDAC6MEN1
SCHEMBL22103860 0.93 NPC1 (0.57) NPC1RAB9AGFERHDAC6MEN1
SCHEMBL22103754 0.93 NPC1 (0.57) NPC1RAB9AGFERHDAC6MEN1
SCHEMBL22591537 0.92 NPC1 (0.56) NPC1RAB9AGFERHDAC6MEN1
SCHEMBL13133822 0.90 NPC1 (0.53) NPC1RAB9AGFERHDAC6MEN1
SCHEMBL13133820 0.90 NPC1 (0.53) NPC1RAB9AGFERHDAC6MEN1
SCHEMBL13133812 0.90 NPC1 (0.53) NPC1RAB9AGFERHDAC6MEN1
SCHEMBL13426626 0.88 HDAC6 (0.47) NPC1RAB9AGFERHDAC6MEN1
SCHEMBL23667885 0.88 HDAC6 (0.53) NPC1RAB9AGFERHDAC6MEN1
SCHEMBL25811169 0.87 TP53 (0.47) NPC1RAB9AGFERHDAC6MEN1

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-20220017503-A1 TRIBENZAZOLE AMINE DERIVATIVE AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME LAPTO CO., LTD. (KR) 2022-01-20 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-20220017503-A1 TRIBENZAZOLE AMINE DERIVATIVE AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME CYP2E1, CYP1B1, ODC1 NPC1 4030/4885RAB9A 2949/4885GFER 958/4885

“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.