SCHEMBL24622643

SCHEMBL24622643

c1ccc2c(c1)-c1ccc(-c3c4ccccc4c(-c4ccc(-c5ccc6c(c5)oc5ccccc56)cc4)c4ccccc34)cc1C21C2CC3CC(C2)CC1C3

nearest known ligand 0.32

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.32
RAB9A P51151 2/20 0.32
MMP12 P39900 1/20 0.32
MMP13 P45452 1/20 0.32
ATM Q13315 1/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
LMNA P02545 1/20 0.32
GAA P10253 1/20 0.32
HTT P42858 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
AHR P35869 1/20 0.32
KDM4E B2RXH2 1/20 0.31
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31
HPGD P15428 1/20 0.31
HCRTR1 O43613 1/20 0.31
PRKDC P78527 1/20 0.30
L3MBTL1 Q9Y468 1/20 0.30
PDK2 Q15119 1/20 0.30

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
SCHEMBL24622685 1.00 NPC1 (0.32) NPC1RAB9AMMP12MMP13ATM
SCHEMBL24622569 0.97 AHR (0.33) NPC1RAB9AMEN1KMT2ALMNA
SCHEMBL24622650 0.94 HSP90AA1 (0.32) NPC1RAB9AMEN1KMT2ALMNA
SCHEMBL24622832 0.93 PRKDC (0.32) MEN1KMT2AAHRKDM4EALDH1A1
SCHEMBL25614669 0.91 MEN1 (0.32) NPC1RAB9AMMP12MMP13ATM
SCHEMBL24622798 0.90 HSP90AA1 (0.34) NPC1RAB9AMEN1KMT2ALMNA
SCHEMBL24622816 0.90 MEN1 (0.35) NPC1RAB9AMEN1KMT2ALMNA
SCHEMBL24622800 0.90
SCHEMBL24622647 0.89 MEN1 (0.30) NPC1RAB9AMEN1KMT2ALMNA
SCHEMBL25614656 0.88 ALDH1A1 (0.33) MEN1KMT2ALMNAAHRKDM4E

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-20220220049-A1 ORGANIC COMPOUND, ORGANIC ELECTROLUMINESCENT DEVICE AND ELECTRONIC APPARATUS SHAANXI LIGHTE OPTOELECTRONICS MATERIAL CO., LTD. (CN) 2022-07-14 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-20220220049-A1 ORGANIC COMPOUND, ORGANIC ELECTROLUMINESCENT DEVICE AND ELECTRONIC APPARATUS HCN2, EPCAM, EFNA1 NPC1 2470/4885RAB9A 111/4885MMP12 3274/4885

“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.