SCHEMBL10051385

SCHEMBL10051385

c1ccc(-c2ccc(-c3nc(-c4ccc(-c5ccc(-c6cc(-c7ccc(-c8ccc9ncccc9c8)cc7)nc(-c7ccc(-c8ccccc8)cc7)n6)cc5)cc4)cc(-c4ccc(-c5ccc6ncccc6c5)cc4)n3)cc2)cc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.66
POLB P06746 1/20 0.66
RAB9A P51151 1/20 0.66
DYRK1A Q13627 1/20 0.54
ALDH1A1 P00352 4/20 0.51
MEN1 O00255 3/20 0.51
KMT2A Q03164 3/20 0.51
MAPT P10636 3/20 0.51
HPGD P15428 2/20 0.51
NTSR1 P30989 1/20 0.51
MCL1 Q07820 1/20 0.50
ABCB1 P08183 1/20 0.50
ABCC1 P33527 1/20 0.50
ABCG2 Q9UNQ0 1/20 0.50
TOP1 P11387 2/20 0.46
CYP2A6 P11509 1/20 0.46
ATR Q13535 1/20 0.45
MAP3K8 P41279 1/20 0.45
KDM4E B2RXH2 2/20 0.45
LMNA P02545 1/20 0.45

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
SCHEMBL12579372 1.00 NPC1 (0.66) NPC1POLBRAB9ADYRK1AALDH1A1
SCHEMBL17945405 1.00 NPC1 (0.66) NPC1POLBRAB9ADYRK1AALDH1A1
SCHEMBL10051382 1.00 NPC1 (0.66) NPC1POLBRAB9ADYRK1AALDH1A1
SCHEMBL10051285 1.00 NPC1 (0.66) NPC1POLBRAB9ADYRK1AALDH1A1
SCHEMBL10051283 1.00 NPC1 (0.66) NPC1POLBRAB9ADYRK1AALDH1A1
SCHEMBL10051282 0.95 NPC1 (0.72) NPC1POLBRAB9ADYRK1AALDH1A1
SCHEMBL10051492 0.95 NPC1 (0.72) NPC1POLBRAB9ADYRK1AALDH1A1
SCHEMBL17343342 0.92 NPC1 (0.64) NPC1POLBRAB9ADYRK1AALDH1A1
SCHEMBL17932553 0.92 NPC1 (0.72) NPC1POLBRAB9ADYRK1AALDH1A1
SCHEMBL12579381 0.91 NPC1 (0.62) NPC1POLBRAB9ADYRK1AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120104941-A1 COMPOUND FOR AN ORGANIC PHOTOELECTRIC DEVICE AND ORGANIC PHOTOELECTRIC DEVICE INCLUDING THE SAME CHEIL INDUSTRIES, INC. (KR) 2012-05-03 US disclosed
US-20120104941-A1 COMPOUND FOR AN ORGANIC PHOTOELECTRIC DEVICE AND ORGANIC PHOTOELECTRIC DEVICE INCLUDING THE SAME CHEIL INDUSTRIES, INC. (KR) 2012-05-03 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-20120104941-A1 COMPOUND FOR AN ORGANIC PHOTOELECTRIC DEVICE AND ORGANIC PHOTOELECTRIC DEVICE INCLUDING THE SAME PPOX, TYR, VDAC3 NPC1 4713/4885POLB 490/4885RAB9A 2477/4885

“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.