SCHEMBL25112770

SCHEMBL25112770

Cn1c(-c2ccccc2)nc2cc(-c3ncc(-c4cc5ccc6cccc7c8cccc9ccc%10cccc(c(c4)c5c67)c%10c98)cn3)ccc21

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE10A Q9Y233 2/20 0.48
▸ HDAC1 Q13547 1/20 0.43
▸ HDAC8 Q9BY41 1/20 0.43
▸ HDAC6 Q9UBN7 1/20 0.43
▸ TLR7 Q9NYK1 1/20 0.41
▸ PTGER4 P35408 4/20 0.41
▸ ATM Q13315 1/20 0.41
▸ NAMPT P43490 1/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ ALOX5AP P20292 1/20 0.38
▸ HPGDS O60760 1/20 0.37
▸ KDM4E B2RXH2 1/20 0.37
▸ NPC1 O15118 1/20 0.37
▸ ALDH1A1 P00352 1/20 0.37
▸ TP53 P04637 1/20 0.37
▸ GAA P10253 1/20 0.37
▸ PKM P14618 1/20 0.37
▸ ALOX15 P16050 1/20 0.37
▸ RAB9A P51151 1/20 0.37

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
SCHEMBL25112772 0.88 NLRP3 (0.51) PTGER4MEN1KMT2AKDM4ENPC1
SCHEMBL25112812 0.84 MEN1 (0.45) TLR7MEN1KMT2AKDM4ENPC1
SCHEMBL25112867 0.84 MEN1 (0.48) HDAC1HDAC8HDAC6TLR7PTGER4
SCHEMBL25112829 0.77 ALDH1A1 (0.48) HDAC1HDAC8HDAC6PTGER4MEN1
SCHEMBL9611745 0.76 PDE10A (0.47) PDE10AHDAC1HDAC8HDAC6TLR7
SCHEMBL9976945 0.76 PDE10A (0.47) PDE10AHDAC1HDAC8HDAC6TLR7
SCHEMBL338433 0.75 PDE10A (0.54) PDE10AHDAC1HDAC8HDAC6TLR7
SCHEMBL12912451 0.75 PDE10A (0.47) PDE10AHDAC1HDAC8HDAC6TLR7
SCHEMBL25112774 0.74 ESR1 (0.41) TLR7MEN1KMT2AKDM4EALDH1A1
SCHEMBL8406032 0.74 PDE10A (0.50) PDE10AHDAC1HDAC8HDAC6TLR7

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 PDE10A 2569/4885HDAC1 1210/4885HDAC8 4107/4885

“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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