SCHEMBL29312037

SCHEMBL29312037

c1nc(N2CCN3CCN=C32)ncc1N1CCN2CCN=C21

nearest known ligand 0.32

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 1/20 0.32
OPRL1 P41146 1/20 0.32
HTR3A P46098 2/20 0.32
HRH4 Q9H3N8 1/20 0.32
MAPT P10636 3/20 0.31
SIGMAR1 Q99720 2/20 0.31
LMNA P02545 1/20 0.31
TSHR P16473 2/20 0.30
ALDH1A1 P00352 1/20 0.30
GAA P10253 1/20 0.30
HPGD P15428 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
HSD17B10 Q99714 1/20 0.30
KDM2B Q8NHM5 3/20 0.30
MAPK1 P28482 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL9803211 0.72 SIGMAR1 (0.60) MAPTSIGMAR1LMNATSHRALDH1A1
SCHEMBL23076104 0.60 TSHR (0.41) LMNATSHRALDH1A1KMT2A
SCHEMBL23075907 0.60 POLB (0.39) LMNATSHRKMT2A
SCHEMBL23076109 0.58 POLB (0.34) MAPTLMNATSHRALDH1A1KMT2A
SCHEMBL23075910 0.58 INMT (0.41) LMNATSHRALDH1A1SMN1; SMN2KMT2A
SCHEMBL1316573 0.56 NOS1 (0.40) SIGMAR1LMNATSHRALDH1A1GAA
SCHEMBL23075870 0.55 TSHR (0.37) HRH4LMNATSHRALDH1A1KMT2A
SCHEMBL23075889 0.55 POLB (0.38) LMNATSHRALDH1A1KMT2A
SCHEMBL15086876 0.55 KDM2B (0.32) KDM2B
SCHEMBL20231574 0.54 OGA (0.40) HTR3AHRH4MAPTSIGMAR1LMNA

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 OPRM1 6/4885OPRL1 66/4885HTR3A 831/4885

“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.