SCHEMBL25720703

SCHEMBL25720703

CC1(c2ccc(-c3nc(-c4cccnc4)nc(-c4cccc(B5OC(C)(C)C(C)(C)O5)c4)n3)cc2)C[C@@H]2CC[C@@H](C2)C1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.41
GBA1 P04062 5/20 0.35
LPL P06858 3/20 0.33
LIPG Q9Y5X9 3/20 0.33
CYP1A2 P05177 3/20 0.32
NPC1 O15118 3/20 0.32
RAB9A P51151 3/20 0.32
CYP11B1 P15538 2/20 0.32
CYP11B2 P19099 2/20 0.32
MAPT P10636 2/20 0.32
CYP3A4 P08684 2/20 0.32
CYP2C9 P11712 2/20 0.32
CYP2B6 P20813 1/20 0.32
PPARA Q07869 1/20 0.32
SMN1; SMN2 Q16637 3/20 0.31
TP53 P04637 2/20 0.31
ALDH1A1 P00352 1/20 0.31
NFKB1 P19838 1/20 0.31
NFKB2 Q00653 1/20 0.31
RELA Q04206 1/20 0.31

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
SCHEMBL25709715 0.89 TSHR (0.49) TSHRGBA1LPLLIPGCYP1A2
SCHEMBL25720516 0.83 LIPG (0.48) LPLLIPG
SCHEMBL25720660 0.83 LIPG (0.51) TSHRLPLLIPGMAPTSMN1; SMN2
SCHEMBL25720497 0.82 LIPG (0.42) LPLLIPG
SCHEMBL25720700 0.81 TSHR (0.35) TSHRGBA1LPLLIPGCYP1A2
SCHEMBL22650209 0.80 LIPG (0.42) TSHRLPLLIPGCYP1A2NPC1
SCHEMBL22649960 0.79 LIPG (0.51) TSHRLPLLIPGCYP1A2NPC1
SCHEMBL31074752 0.79 HTT (0.44) TSHRLPLLIPGNPC1RAB9A
SCHEMBL25720487 0.75 TSHR (0.37) TSHRGBA1CYP1A2CYP3A4CYP2C9
SCHEMBL31074756 0.75 HTT (0.44) TSHRGBA1LPLLIPGNPC1

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-11746093-B2 Nitrogen-containing compound, electronic element, and electronic device SHAANXI LIGHTE OPTOELECTRONICS MATERIAL CO., LTD. (CN) 2023-09-05 US disclosed
US-20230192627-A1 NITROGEN-CONTAINING COMPOUND, ELECTRONIC ELEMENT, AND ELECTRONIC DEVICE SHAANXI LIGHTE OPTOELECTRONICS MATERIAL CO., LTD. (CN) 2023-06-22 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 (2 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-11746093-B2 Nitrogen-containing compound, electronic element, and electronic device SLC43A1, SLC7A5, L1CAM TSHR 4832/4885GBA1 4017/4885LPL 4449/4885
US-20230192627-A1 NITROGEN-CONTAINING COMPOUND, ELECTRONIC ELEMENT, AND ELECTRONIC DEVICE SLC43A1, SLC7A5, L1CAM TSHR 4832/4885GBA1 4017/4885LPL 4449/4885

“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.