SCHEMBL23938205

SCHEMBL23938205

Clc1cccc(CNc2ccc(I)cn2)c1

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HDAC3 O15379 1/20 0.51
HDAC1 Q13547 1/20 0.51
HDAC2 Q92769 1/20 0.51
HDAC6 Q9UBN7 1/20 0.51
MAP4K4 O95819 1/20 0.50
FYN P06241 4/20 0.47
VNN1 O95497 2/20 0.44
GRM4 Q14833 1/20 0.44
CDC7 O00311 1/20 0.43
DBF4 Q9UBU7 1/20 0.43
GAA P10253 1/20 0.43
MAPT P10636 1/20 0.43
CHRM2 P08172 1/20 0.43
CCNT1 O60563 2/20 0.43
TMIGD3 P0DMS9 1/20 0.42
HTR2C P28335 1/20 0.42
HTR2B P41595 1/20 0.42

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
SCHEMBL22191269 0.84 HDAC3 (0.63) HDAC3HDAC1HDAC2HDAC6MAP4K4
SCHEMBL24729874 0.82 ALDH1A1 (0.52) HDAC3HDAC1HDAC2HDAC6MAP4K4
SCHEMBL20731983 0.82 FYN (0.59) HDAC3HDAC1HDAC2HDAC6MAP4K4
SCHEMBL22191739 0.81 FABP1 (0.58) HDAC3HDAC1HDAC2HDAC6VNN1
SCHEMBL23938195 0.79 HDAC3 (0.54) HDAC3HDAC1HDAC2HDAC6MAP4K4
SCHEMBL24457942 0.78 FFAR1 (0.49) GAA
SCHEMBL11567300 0.78 HDAC3 (0.60) HDAC3HDAC1HDAC2HDAC6VNN1
SCHEMBL23938199 0.77 KDM4E (0.69) HDAC3HDAC1HDAC2HDAC6MAP4K4
SCHEMBL29580199 0.77 KDM4E (0.69) HDAC3HDAC1HDAC2HDAC6MAP4K4
SCHEMBL20874965 0.76 APP (0.48) HDAC3HDAC1HDAC2HDAC6MAP4K4

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-11524966-B1 Carboxamides as ubiquitin-specific protease inhibitors VALO HEALTH, INC. (US) 2022-12-13 US disclosed
US-20210323975-A1 CARBOXAMIDES AS UBIQUITIN-SPECIFIC PROTEASE INHIBITORS VALO EARLY DISCOVERY, INC. 2021-10-21 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 (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-11524966-B1 Carboxamides as ubiquitin-specific protease inhibitors USP28, USP25, USP24 HDAC3 160/4885HDAC1 130/4885HDAC2 121/4885
US-20210323975-A1 CARBOXAMIDES AS UBIQUITIN-SPECIFIC PROTEASE INHIBITORS USP28, USP25, USP24 HDAC3 160/4885HDAC1 130/4885HDAC2 121/4885

“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.