SCHEMBL25518372

SCHEMBL25518372

Cc1cc2ccccc2cc1-c1ccc2ccccc2[n+]1C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 13/20 0.38
POLB P06746 4/20 0.36
KMT2A Q03164 4/20 0.36
BCHE P06276 4/20 0.35
CYP2A6 P11509 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
CYP11B1 P15538 2/20 0.35
CYP11B2 P19099 2/20 0.35
MEN1 O00255 2/20 0.34
MAPT P10636 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
NPC1 O15118 1/20 0.33
LMNA P02545 1/20 0.33
THRB P10828 1/20 0.33
PKM P14618 1/20 0.33
MAPK1 P28482 1/20 0.33
HTT P42858 1/20 0.33
RECQL P46063 1/20 0.33
RAB9A P51151 1/20 0.33
BLM P54132 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
SCHEMBL26836501 0.87 CYP2A6 (0.47) ACHEPOLBKMT2ACYP2A6TDP1
SCHEMBL26836845 0.86 ALDH1A1 (0.45) ACHEKMT2ACYP2A6TDP1MEN1
SCHEMBL26836499 0.84 UGT2B7 (0.38) KMT2ACYP2A6TDP1CYP11B1CYP11B2
SCHEMBL25494030 0.83 CYP2A6 (0.41) ACHEPOLBKMT2ABCHECYP2A6
SCHEMBL25639529 0.83 CYP2A6 (0.41) ACHEPOLBKMT2ABCHECYP2A6
SCHEMBL26836502 0.82 UGT2B7 (0.41) KMT2ACYP2A6TDP1MEN1LMNA
SCHEMBL25445417 0.82 ACHE (0.40) ACHEPOLBKMT2ABCHECYP2A6
SCHEMBL26834643 0.80 LMNA (0.46) ACHEPOLBKMT2ABCHEMEN1
SCHEMBL25518232 0.79 CYP2A6 (0.37) ACHEPOLBKMT2ABCHECYP2A6
SCHEMBL26837010 0.79 CYP11B1 (0.38) KMT2ACYP2A6TDP1CYP11B1CYP11B2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230382935-A1 COMPOUND CONTAINING 1,3-DIKETONE LIGAND AND APPLICATION THEREOF, AND ORGANIC ELECTROLUMINESCENT DEVICE BEIJING GREEN GUARDEE TECHNOLOGY CO., LTD. (CN) 2023-11-30 US disclosed
US-20230309394-A1 ORGANIC ELECTROLUMINESCENT DEVICE Beijing Summer Sprout Technology Co., Ltd. (CN) 2023-09-28 US disclosed
US-20230250118-A1 ELECTROLUMINESCENT MATERIAL AND DEVICE THEREOF Beijing Summer Sprout Technology Co., Ltd. (CN) 2023-08-10 US disclosed
US-20230144101-A1 LIGHT-EMITTING MATERIAL WITH A POLYCYCLIC LIGAND Beijing Summer Sprout Technology Co., Ltd. (CN) 2023-05-11 US disclosed
EP-4174078-A1 ELECTROLUMINESCENT MATERIAL AND DEVICE THEREOF Beijing Summer Sprout Technology Co., Ltd. (CN) 2023-05-03 EP 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 (3 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-20230250118-A1 ELECTROLUMINESCENT MATERIAL AND DEVICE THEREOF CRY1, LEF1, PIEZO1 ACHE 331/4885POLB 3088/4885KMT2A 1651/4885
US-20230144101-A1 LIGHT-EMITTING MATERIAL WITH A POLYCYCLIC LIGAND TRPC4, CRY1, TRPC1 ACHE 939/4885POLB 2366/4885KMT2A 322/4885
US-20230382935-A1 COMPOUND CONTAINING 1,3-DIKETONE LIGAND AND APPLICATION THEREOF, AND ORGANIC ELECTROLUMINESCENT DEVICE TLK1, TLK2, PDK3 ACHE 3626/4885POLB 1383/4885KMT2A 3073/4885

“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.