SCHEMBL21229034

SCHEMBL21229034

CN1CCN(c2ncc(CNC(=O)O)s2)CC1

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.50
SNCA P37840 1/20 0.42
HDAC2 Q92769 2/20 0.42
HDAC3 O15379 1/20 0.41
HDAC4 P56524 1/20 0.41
HDAC1 Q13547 1/20 0.41
HDAC7 Q8WUI4 1/20 0.41
HDAC10 Q969S8 1/20 0.41
HDAC11 Q96DB2 1/20 0.41
HDAC8 Q9BY41 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41
HDAC9 Q9UKV0 1/20 0.41
HDAC5 Q9UQL6 1/20 0.41
MAPK8 P45983 1/20 0.40

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
SCHEMBL3054616 0.87 TDP1 (0.48) TDP1SNCAHDAC2HDAC3HDAC4
SCHEMBL21229101 0.85 GAA (0.51) TDP1MAPK8
SCHEMBL21229095 0.84 GAA (0.36) HDAC2HDAC3HDAC4HDAC1HDAC7
SCHEMBL18667020 0.83 TDP1 (0.44) TDP1SNCA
SCHEMBL26140316 0.78 TDP1 (0.55) TDP1
SCHEMBL10233477 0.76 TDP1 (0.57) TDP1
SCHEMBL3071381 0.76 LMNA (0.43) TDP1HDAC2HDAC3HDAC4HDAC1
SCHEMBL18641473 0.75 TDP1 (0.55) TDP1
SCHEMBL18641366 0.75 TDP1 (0.49) TDP1SNCAHDAC2
SCHEMBL3168739 0.74 TDP1 (0.58) TDP1SNCAHDAC2HDAC3HDAC4

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-10377748-B2 Hepatitis B core protein modulators ASSEMBLY BIOSCIENCES, INC. (US) 2019-08-13 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-10377748-B2 Hepatitis B core protein modulators HAVCR2, FABP1, MAVS TDP1 4337/4885SNCA 3703/4885HDAC2 3158/4885

“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.