SCHEMBL25112763

SCHEMBL25112763

Cc1nc2ccccc2n1-c1ncc(-c2cc3ccc4cccc5c6cccc7ccc8cccc(c(c2)c3c45)c8c76)cn1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HTT P42858 2/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ PIK3CD O00329 3/20 0.39
▸ PIK3CA P42336 3/20 0.39
▸ PIK3CB P42338 1/20 0.39
▸ PIK3CG P48736 1/20 0.39
▸ TSHR P16473 2/20 0.39
▸ MTOR P42345 2/20 0.38
▸ VCP P55072 2/20 0.37
▸ NPC1 O15118 1/20 0.36
▸ RAB9A P51151 1/20 0.36
▸ MAPT P10636 2/20 0.36
▸ HSD17B10 Q99714 2/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ TP53 P04637 1/20 0.36
▸ POLB P06746 1/20 0.36
▸ CHEK1 O14757 1/20 0.35
▸ ATR Q13535 1/20 0.35
▸ PDCD1 Q15116 1/20 0.35

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
SCHEMBL25112774 0.88 ESR1 (0.41) PIK3CDPIK3CAPIK3CBPIK3CGTSHR
SCHEMBL25112841 0.87 ALDH1A1 (0.41) HTTMAPK1PIK3CDPIK3CAPIK3CB
SCHEMBL25112866 0.83 MAPK1 (0.46) HTTMAPK1PIK3CDPIK3CAPIK3CB
SCHEMBL25112852 0.81 MAPK1 (0.46) HTTMAPK1PIK3CDPIK3CATSHR
SCHEMBL25112821 0.80 ESR1 (0.40) HTTMAPK1KDM4EATRERBB2
SCHEMBL25112812 0.80 MEN1 (0.45) HTTMAPK1NPC1RAB9AMAPT
SCHEMBL25112699 0.79 TSHR (0.42) HTTMAPK1PIK3CDPIK3CAPIK3CB
SCHEMBL25112775 0.79 MAPK1 (0.49) HTTMAPK1PIK3CDPIK3CATSHR
SCHEMBL25112808 0.78 ALDH1A1 (0.44) HTTNPC1RAB9AMAPTHSD17B10
SCHEMBL25112832 0.78 BMI1 (0.39) MAPK1TSHRRAB9AMAPTKDM4E

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 HTT 3295/4885MAPK1 154/4885PIK3CD 4690/4885

“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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