SCHEMBL24618007

SCHEMBL24618007

c1ccc(-c2ccc(-c3nc(-c4ccccc4)nc(-c4cccc(-c5cccc(-c6ccc(-c7ccc8c(c7)C7(c9cccc(-c%10cccc(-c%11cccc(-c%12nc(-c%13ccccc%13)nc(-c%13ccc(-c%14ccccc%14)cc%13)n%12)c%11)c%10)c9-8)C8CC9CC(C8)CC7C9)cc6)c5)c4)n3)cc2)cc1

nearest known ligand 0.34

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.34
PDK2 Q15119 5/20 0.33
GP6 Q9HCN6 1/20 0.33
HSD11B1 P28845 1/20 0.32
MEN1 O00255 2/20 0.32
ALDH1A1 P00352 2/20 0.32
MAPT P10636 2/20 0.32
HPGD P15428 2/20 0.32
KMT2A Q03164 2/20 0.32
KDM4E B2RXH2 1/20 0.32
LMNA P02545 1/20 0.32
GLA P06280 1/20 0.32
PTPN11 Q06124 1/20 0.31
PTPRCAP Q14761 1/20 0.31
TSHR P16473 1/20 0.30
MAPK1 P28482 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL24618035 1.00 HTT (0.34) HTTPDK2GP6HSD11B1MEN1
SCHEMBL24618079 0.98 HTT (0.36) HTTPDK2HSD11B1MEN1ALDH1A1
SCHEMBL24618002 0.96 HTT (0.36) HTTPDK2HSD11B1MEN1ALDH1A1
SCHEMBL24618132 0.94 HTT (0.35) HTTPDK2GP6HSD11B1MEN1
SCHEMBL24618351 0.94 HTT (0.36) HTTPDK2HSD11B1MEN1ALDH1A1
SCHEMBL24617985 0.93 HTT (0.36) HTTPDK2HSD11B1MEN1ALDH1A1
SCHEMBL23605905 0.93 HTT (0.37) HTTPDK2GP6TSHR
SCHEMBL24618119 0.92 HTT (0.36) HTTPDK2HSD11B1MEN1ALDH1A1
SCHEMBL24618041 0.91 HTT (0.34) HTTGP6HSD11B1
SCHEMBL24618036 0.90 HTT (0.38) HTTHSD11B1MEN1ALDH1A1MAPT

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-20220223796-A1 ORGANIC COMPOUND, ELECTRONIC COMPONENT CONTAINING ORGANIC COMPOUND, AND ELECTRONIC DEVICE 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-20220223796-A1 ORGANIC COMPOUND, ELECTRONIC COMPONENT CONTAINING ORGANIC COMPOUND, AND ELECTRONIC DEVICE EXOC1, EXOC4, CHRM1 HTT 4085/4885PDK2 2798/4885GP6 2112/4885

“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.