SCHEMBL17457576

SCHEMBL17457576

CN(CCN(C)C(=O)O)Cc1nn(S(=O)(=O)c2ccccc2)c2ccc(O)cc12

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ HTR6 P50406 8/20 0.45
▸ TNF P01375 3/20 0.37
▸ HTR1A P08908 2/20 0.35
▸ HTR1D P28221 2/20 0.35
▸ HTR1B P28222 2/20 0.35
▸ HTR1F P30939 2/20 0.35
▸ HTR7 P34969 2/20 0.35
▸ TNFSF11 O14788 5/20 0.35
▸ ESR2 Q92731 1/20 0.35
▸ IDE P14735 1/20 0.34
▸ DRD2 P14416 1/20 0.33
▸ DRD3 P35462 1/20 0.33

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
SCHEMBL16120066 0.88 HTR6 (0.41) HTR6TNF
SCHEMBL16100482 0.85 HTR6 (0.46) HTR6HTR1AHTR1DHTR1BHTR1F
SCHEMBL17457571 0.80 HTR6 (0.36) HTR6
SCHEMBL16102368 0.75 HTR6 (0.43) HTR6HTR1AHTR1DHTR1BESR2
SCHEMBL16100818 0.73 HRH1 (0.41) HTR6
SCHEMBL17457568 0.72 MAPT (0.35) HTR6
SCHEMBL16099896 0.69 HTR6 (0.42) HTR6ESR2
SCHEMBL17457582 0.69 HTR2A (0.38) HTR1A
SCHEMBL17457570 0.65 MAPT (0.35) —
SCHEMBL3040501 0.63 IDE (0.55) HTR6IDE

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-9765035-B2 Arginine methyltransferase inhibitors and uses thereof Epizyme, Inc. (US) 2017-09-19 — — US disclosed
US-20160024017-A1 ARGININE METHYLTRANSFERASE INHIBITORS AND USES THEREOF Epizyme, Inc. (US) 2016-01-28 — — 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-20160024017-A1 ARGININE METHYLTRANSFERASE INHIBITORS AND USES THEREOF PRMT1, PRMT3, PRMT5 HTR6 2832/4885TNF 4795/4885HTR1A 4112/4885

“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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