SCHEMBL25993458

SCHEMBL25993458

Cn1c2cc3oc4ccccc4c3cc2c2c(C(C)(C)C)cccc21

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 1/20 0.38
AHR P35869 2/20 0.38
ALDH1A1 P00352 4/20 0.36
NPSR1 Q6W5P4 1/20 0.36
RXFP1 Q9HBX9 1/20 0.36
CYP1A2 P05177 1/20 0.36
MAPT P10636 7/20 0.35
KMT2A Q03164 6/20 0.35
MEN1 O00255 5/20 0.35
KDM4E B2RXH2 3/20 0.35
HPGD P15428 3/20 0.35
NPC1 O15118 2/20 0.35
RAB9A P51151 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
CDC14B O60729 1/20 0.35
CDC14A Q9UNH5 1/20 0.35
GPR3 P46089 1/20 0.34
KIF11 P52732 2/20 0.34
HTT P42858 1/20 0.33
GAA P10253 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
SCHEMBL25682101 0.95 AHR (0.38) MAOAAHRALDH1A1NPSR1RXFP1
SCHEMBL25682329 0.86 GPR3 (0.42) ALDH1A1NPSR1RXFP1MAPTKMT2A
SCHEMBL25993453 0.83 MAOA (0.39) MAOAAHRALDH1A1NPSR1RXFP1
SCHEMBL25993428 0.81 GPR3 (0.42) ALDH1A1NPSR1RXFP1MAPTKMT2A
SCHEMBL25678270 0.80 AHR (0.52) MAOAAHRALDH1A1CYP1A2MAPT
SCHEMBL25993473 0.80 CDC14B (0.40) MAOAALDH1A1NPSR1RXFP1MAPT
SCHEMBL25993562 0.80 MAOA (0.38) MAOAAHRALDH1A1NPSR1RXFP1
SCHEMBL25681617 0.80 HSD17B10 (0.40) MAOAAHRALDH1A1CYP1A2MAPT
SCHEMBL13183675 0.79 GPR3 (0.53) MAOAAHRALDH1A1NPSR1CYP1A2
SCHEMBL25993475 0.77 GPR3 (0.41) ALDH1A1MAPTKMT2AMEN1KDM4E

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-20230265106-A1 COMPOUND, LIGHT-EMITTING MATERIAL, AND LIGHT-EMITTING ELEMENT KYULUX, INC. (JP) 2023-08-24 US disclosed
US-20230265106-A1 COMPOUND, LIGHT-EMITTING MATERIAL, AND LIGHT-EMITTING ELEMENT KYULUX, INC. (JP) 2023-08-24 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-20230265106-A1 COMPOUND, LIGHT-EMITTING MATERIAL, AND LIGHT-EMITTING ELEMENT CRY1, CCNE2, CRY2 MAOA 3076/4885AHR 101/4885ALDH1A1 603/4885

“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.