SCHEMBL25112841

SCHEMBL25112841

Cc1nc2ccccc2n1-c1ccc(-c2cc3ccc4cccc5c6cccc7ccc8cccc(c(c2)c3c45)c8c76)cn1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 2/20 0.41
▸ MAPK1 P28482 1/20 0.39
▸ HTT P42858 1/20 0.39
▸ PIK3CD O00329 4/20 0.39
▸ PIK3CA P42336 4/20 0.39
▸ MTOR P42345 3/20 0.39
▸ TSHR P16473 1/20 0.38
▸ BMI1 P35226 2/20 0.36
▸ MAPT P10636 3/20 0.34
▸ KDM4E B2RXH2 1/20 0.34
▸ LMNA P02545 1/20 0.34
▸ TP53 P04637 1/20 0.34
▸ POLB P06746 1/20 0.34
▸ HSD17B10 Q99714 1/20 0.34
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ MEN1 O00255 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ GSR P00390 1/20 0.34
▸ GAA P10253 1/20 0.34
▸ PIK3CB P42338 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
SCHEMBL25112832 0.89 BMI1 (0.39) ALDH1A1MAPK1TSHRBMI1MAPT
SCHEMBL25112835 0.88 ALDH1A1 (0.41) ALDH1A1MAPTKDM4ELMNATP53
SCHEMBL25112763 0.87 HTT (0.41) ALDH1A1MAPK1HTTPIK3CDPIK3CA
SCHEMBL25112852 0.81 MAPK1 (0.46) ALDH1A1MAPK1HTTPIK3CDPIK3CA
SCHEMBL25112866 0.81 MAPK1 (0.46) ALDH1A1MAPK1HTTPIK3CDPIK3CA
SCHEMBL25112699 0.80 TSHR (0.42) ALDH1A1MAPK1HTTPIK3CDPIK3CA
SCHEMBL25112775 0.79 MAPK1 (0.49) ALDH1A1MAPK1HTTPIK3CDPIK3CA
SCHEMBL25112831 0.79 ESR1 (0.39) ALDH1A1MAPK1HTTPIK3CDPIK3CA
SCHEMBL25112774 0.77 ESR1 (0.41) ALDH1A1PIK3CDPIK3CAMTORTSHR
SCHEMBL25112821 0.76 ESR1 (0.40) ALDH1A1MAPK1HTTKDM4EMEN1

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-20230085328-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE IDEMITSU KOSAN CO.,LTD. (JP) 2023-03-16 — — 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-20230085328-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE L1CAM, PIEZO1, LEF1 ALDH1A1 192/4885MAPK1 154/4885HTT 3295/4885

“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.

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