SCHEMBL29779340

SCHEMBL29779340

CCCC(=O)OCC1c2ccccc2-c2ccccc21

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.50
FABP5 Q01469 3/20 0.49
FABP7 O15540 2/20 0.49
EPHX2 P34913 1/20 0.47
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
CYP1A2 P05177 1/20 0.43
ALDH1A1 P00352 1/20 0.42
CASP3 P42574 1/20 0.42
TNF P01375 2/20 0.41
POLB P06746 1/20 0.41

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
SCHEMBL47693 1.00 KMT2A (0.50) KMT2AFABP5FABP7EPHX2CA1
SCHEMBL30781736 1.00 KMT2A (0.50) KMT2AFABP5FABP7EPHX2CA1
SCHEMBL10071038 0.91 KMT2A (0.50) KMT2AFABP5FABP7EPHX2CA1
SCHEMBL5497604 0.90 KMT2A (0.55) KMT2AFABP5FABP7EPHX2CA1
SCHEMBL14612149 0.89 KMT2A (0.52) KMT2AFABP5FABP7EPHX2CA1
SCHEMBL27984222 0.88 KMT2A (0.54) KMT2AFABP5FABP7EPHX2TNF
SCHEMBL16360194 0.88 KMT2A (0.54) KMT2AFABP5FABP7EPHX2TNF
Hydrochloric Acid SCHEMBL28086829 0.87 KMT2A (0.53) KMT2AFABP5FABP7EPHX2TNF
SCHEMBL4839280 0.87 KMT2A (0.52) KMT2AFABP5FABP7EPHX2CA1
SCHEMBL3623157 0.87 KMT2A (0.55) KMT2AFABP5FABP7EPHX2CA1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12129312-B2 Peptide compound, application thereof and composition containing same XDCEXPLORER (SHANGHAI) CO., LTD. (CN) 2024-10-29 US disclosed
US-20240209023-A1 PEPTIDE COMPOUND, APPLICATION THEREOF AND COMPOSITION CONTAINING SAME XDCEXPLORER (SHANGHAI) CO., LTD. (CN) 2024-06-27 US disclosed
CN-109134610-B Peptide compound, application thereof and composition containing peptide compound 尚华医药科技(江西)有限公司 2022-07-08 CN 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 (2 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-12129312-B2 Peptide compound, application thereof and composition containing same VIP, NGLY1, FURIN KMT2A 4475/4885FABP5 2965/4885FABP7 2056/4885
US-20240209023-A1 PEPTIDE COMPOUND, APPLICATION THEREOF AND COMPOSITION CONTAINING SAME VIP, NGLY1, FURIN KMT2A 4140/4885FABP5 3127/4885FABP7 1990/4885

“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.