SCHEMBL26068381

SCHEMBL26068381

COc1ccc(CSc2nc(=O)ccn2CC(=O)O)c(C)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTGDR2 Q9Y5Y4 8/20 0.46
▸ MAPT P10636 2/20 0.41
▸ MEN1 O00255 2/20 0.41
▸ KMT2A Q03164 2/20 0.41
▸ CYP1A2 P05177 1/20 0.41
▸ CYP3A4 P08684 1/20 0.41
▸ CYP2D6 P10635 1/20 0.41
▸ CYP2C9 P11712 1/20 0.41
▸ CYP2C19 P33261 1/20 0.41
▸ NPSR1 Q6W5P4 1/20 0.41
▸ HTT P42858 1/20 0.39
▸ POLB P06746 2/20 0.39
▸ ATM Q13315 1/20 0.39
▸ KDM4E B2RXH2 2/20 0.38
▸ HPGD P15428 3/20 0.38
▸ ALDH1A1 P00352 2/20 0.38
▸ NPC1 O15118 1/20 0.38
▸ MAPK1 P28482 1/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ SMN1; SMN2 Q16637 1/20 0.38

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
SCHEMBL26068380 0.89 NPC1 (0.40) PTGDR2MAPTMEN1KMT2ACYP1A2
SCHEMBL25921419 0.77 PTGDR2 (0.44) PTGDR2MAPTKMT2AHTTPOLB
SCHEMBL26068383 0.77 LCK (0.34) PTGDR2MAPTMEN1KMT2ACYP1A2
SCHEMBL7593862 0.73 PTGDR2 (0.53) PTGDR2MAPTMEN1KMT2ARAB9A
SCHEMBL3541536 0.71 PLA2G7 (0.53) PTGDR2MEN1KMT2AALDH1A1
SCHEMBL26068379 0.69 LMNA (0.43) MAPTMEN1KMT2ACYP1A2CYP3A4
SCHEMBL25921941 0.67 PLA2G7 (0.42) PTGDR2MAPTMEN1KMT2AHTT
SCHEMBL14876186 0.67 MTNR1A (0.58) KMT2APOLBKDM4EHPGDALDH1A1
SCHEMBL4664847 0.66 HSD17B10 (0.65) MAPTMEN1KMT2AHTTPOLB
SCHEMBL10222047 0.66 MTNR1A (0.61) MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230272381-A1 SINGLE-STRANDED POLYNUCLEOTIDE NATIONAL UNIVERSITY CORPORATION TOKAI NATIONAL HIGHER EDUCATION AND RESEARCH SYSTEM (JP) 2023-08-31 — — 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-20230272381-A1 SINGLE-STRANDED POLYNUCLEOTIDE TRDMT1, ADAR, TARBP1 PTGDR2 3374/4885MAPT 3292/4885MEN1 2412/4885

“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.

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