SCHEMBL10137468

SCHEMBL10137468

O=C(NCC1CCCCC1)OCC1c2ccccc2-c2ccccc21

nearest known ligand 0.54

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.54
EPHX2 P34913 1/20 0.49
EPHX1 P07099 1/20 0.47
OPRD1 P41143 1/20 0.44

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
SCHEMBL24520149 1.00 KMT2A (0.54) KMT2AEPHX2EPHX1OPRD1
SCHEMBL10137494 0.99 KMT2A (0.55) KMT2AEPHX2EPHX1OPRD1
SCHEMBL30759497 0.96 KMT2A (0.55) KMT2AEPHX2OPRD1
SCHEMBL13020981 0.93 KMT2A (0.57) KMT2AEPHX2OPRD1
SCHEMBL6762266 0.87 KMT2A (0.52) KMT2AEPHX2
SCHEMBL23571459 0.87 F2 (0.53) KMT2AEPHX2OPRD1
SCHEMBL3046952 0.87 KMT2A (0.56) KMT2AEPHX2
SCHEMBL119618 0.86 KMT2A (0.54) KMT2AEPHX2OPRD1
SCHEMBL31693430 0.86 KMT2A (0.54) KMT2AEPHX2OPRD1
SCHEMBL30309102 0.86 KMT2A (0.54) KMT2AEPHX2OPRD1

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
WO-2023083209-A1 LIGAND COMPOUND TARGETING PSMA ANTIGEN, AND CHELATE AND USE THEREOF IN DIAGNOSIS AND TREATMENT OF PROSTATE CANCER 苏州瑞核医药科技有限公司 2023-05-19 WO disclosed
US-20120021530-A1 HETEROGENEOUS FOLDAMERS CONTAINING alpha, beta, and/or gamma-AMINO ACIDS WISCONSIN ALUMNI RESEARCH FOUNDATION 2012-01-26 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-20120021530-A1 HETEROGENEOUS FOLDAMERS CONTAINING alpha, beta, and/or gamma-AMINO ACIDS DNPEP, PRKCSH, YWHAZ KMT2A 3597/4885EPHX2 2808/4885EPHX1 3782/4885

“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.