SCHEMBL29312032

SCHEMBL29312032

c1cc(N2CCN3CCN=C32)nc(N2CCN3CCN=C32)c1

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HTR3A P46098 7/20 0.40
HTR3E A5X5Y0 4/20 0.40
HTR3B O95264 4/20 0.40
HTR3D Q70Z44 4/20 0.40
HTR3C Q8WXA8 4/20 0.40
GRIN2D O15399 2/20 0.35
GRIN3B O60391 2/20 0.35
GRIN1 Q05586 2/20 0.35
GRIN2A Q12879 2/20 0.35
GRIN2B Q13224 2/20 0.35
GRIN2C Q14957 2/20 0.35
GRIN3A Q8TCU5 2/20 0.35
KDM2B Q8NHM5 6/20 0.33
GAA P10253 2/20 0.32
ALDH1A1 P00352 2/20 0.32
KDM4E B2RXH2 1/20 0.32
KMT2A Q03164 1/20 0.32
GFER P55789 1/20 0.32
SIGMAR1 Q99720 1/20 0.32

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
SCHEMBL29312035 0.82 HTR3A (0.42) HTR3AHTR3EHTR3BHTR3DHTR3C
SCHEMBL23075232 0.82 POLB (0.39) HTR3AHTR3EHTR3BHTR3DHTR3C
SCHEMBL29312039 0.78 NOS1 (0.30)
SCHEMBL29312031 0.78 ADRA2C (0.41) KDM2BALDH1A1SIGMAR1
SCHEMBL23075895 0.75 POLB (0.36) ALDH1A1KMT2A
SCHEMBL23075773 0.72 POLB (0.34) KMT2A
SCHEMBL9803211 0.69 SIGMAR1 (0.60) KDM2BGAAALDH1A1KMT2AGFER
SCHEMBL29312037 0.69 OPRM1 (0.32) HTR3AKDM2BGAAALDH1A1KMT2A
SCHEMBL23075892 0.68 LMNA (0.42) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL29312041 0.64 PDK2 (0.34)

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-20240237526-A1 ORGANIC COMPOUND, LIGHT-EMITTING DEVICE, LIGHT-EMITTING APPARATUS, AND ELECTRONIC DEVICE SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2024-07-11 US disclosed
US-20240237526-A1 ORGANIC COMPOUND, LIGHT-EMITTING DEVICE, LIGHT-EMITTING APPARATUS, AND ELECTRONIC DEVICE SEMICONDUCTOR ENERGY LABORATORY CO., LTD. (JP) 2024-07-11 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-20240237526-A1 ORGANIC COMPOUND, LIGHT-EMITTING DEVICE, LIGHT-EMITTING APPARATUS, AND ELECTRONIC DEVICE CHRM1, CYP1A1, HAX1 HTR3A 831/4885HTR3E 1374/4885HTR3B 1339/4885

“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.