SCHEMBL19632744

SCHEMBL19632744

CC(C)(C)c1ccc2c(c1)-c1ccccc1C21c2ccccc2-c2cnccc21

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.41
ALDH1A1 P00352 1/20 0.41
PLA2G1B P04054 1/20 0.41
NFKB1 P19838 1/20 0.41
CASP3 P42574 1/20 0.41
RAB9A P51151 1/20 0.41
NFKB2 Q00653 1/20 0.41
RELA Q04206 1/20 0.41
SENP8 Q96LD8 1/20 0.41
SENP7 Q9BQF6 1/20 0.41
SENP6 Q9GZR1 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
ATG4B Q9Y4P1 1/20 0.41
KIF11 P52732 3/20 0.36
KDR P35968 1/20 0.35
PDK2 Q15119 7/20 0.33
MAOA P21397 1/20 0.33
MAOB P27338 1/20 0.33
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33

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
SCHEMBL19633155 1.00 NPC1 (0.41) NPC1ALDH1A1PLA2G1BNFKB1CASP3
SCHEMBL19656609 0.86 ALDH1A1 (0.52) NPC1ALDH1A1PLA2G1BNFKB1CASP3
SCHEMBL19009212 0.81 MAOA (0.47) L3MBTL1PDK2MAOAMAOBKDM4E
SCHEMBL19009209 0.81 MAOA (0.47) L3MBTL1PDK2MAOAMAOBKDM4E
SCHEMBL30322811 0.81 MAOA (0.47) L3MBTL1PDK2MAOAMAOBKDM4E
SCHEMBL21215242 0.76 ALDH1A1 (0.52) NPC1ALDH1A1PLA2G1BNFKB1CASP3
SCHEMBL25858113 0.76 ALDH1A1 (0.52) NPC1ALDH1A1PLA2G1BNFKB1CASP3
SCHEMBL30421958 0.76 ALDH1A1 (0.52) NPC1ALDH1A1PLA2G1BNFKB1CASP3
SCHEMBL19934339 0.76 ALDH1A1 (0.52) NPC1ALDH1A1PLA2G1BNFKB1CASP3
SCHEMBL19773711 0.75 ALDH1A1 (0.50) NPC1ALDH1A1PLA2G1BNFKB1CASP3

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-20170338422-A1 Electron Transport Material, An OLED Display Panel And An Electronic Device Compromising The Same WUHAN TIANMA MICRO-ELECTRONICS CO., LTD. (CN) 2017-11-23 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-20170338422-A1 Electron Transport Material, An OLED Display Panel And An Electronic Device Compromising The Same OCIAD1, OCIAD2, SLCO4C1 NPC1 454/4885ALDH1A1 904/4885PLA2G1B 2071/4885

“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.