SCHEMBL18153373

SCHEMBL18153373

NC(=O)c1ccccc1C(=O)NOCCCO

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 8/20 0.47
HDAC3 O15379 7/20 0.47
HDAC4 P56524 7/20 0.47
HDAC1 Q13547 7/20 0.47
HDAC7 Q8WUI4 7/20 0.47
HDAC2 Q92769 7/20 0.47
HDAC10 Q969S8 7/20 0.47
HDAC11 Q96DB2 7/20 0.47
HDAC8 Q9BY41 7/20 0.47
HDAC9 Q9UKV0 7/20 0.47
HDAC5 Q9UQL6 7/20 0.47
MAP2K1 Q02750 5/20 0.43
MAPT P10636 2/20 0.41
MEN1 O00255 1/20 0.41
NR1I2 O75469 1/20 0.41
LMNA P02545 1/20 0.41
CHRM2 P08172 1/20 0.41
CYP3A4 P08684 1/20 0.41
ADRA2A P08913 1/20 0.41
OPRK1 P41145 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
SCHEMBL9703918 0.83 HDAC3 (0.47) HDAC6HDAC3HDAC4HDAC1HDAC7
SCHEMBL6295923 0.77 MAP2K1 (0.55) HDAC6HDAC3HDAC4HDAC1HDAC7
SCHEMBL7255678 0.77 HTT (0.62) MAPTKDM4EALDH1A1HPGDTSHR
SCHEMBL28893760 0.75 NPC1 (0.65) HDAC6HDAC3HDAC4HDAC1HDAC7
SCHEMBL27388239 0.75 KDM4E (0.50) MAPTSIRT1BCAT2KDM4EALDH1A1
SCHEMBL7114649 0.75 LMNA (0.69) HDAC6MAPTMEN1NR1I2LMNA
SCHEMBL15057855 0.74 HTT (0.56) HDAC3HDAC1KDM4EALDH1A1HPGD
SCHEMBL143432 0.73 ALDH1A1 (0.49) HDAC6HDAC3HDAC4HDAC1HDAC7
SCHEMBL8759237 0.73 TSHR (0.50) HDAC6HDAC3HDAC4HDAC1HDAC7
SCHEMBL4138337 0.73 CTSD (0.55) MAPTMEN1KMT2ABCAT2KDM4E

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-10718028-B2 Fluorescent probes for abasic site detection CASE WESTERN RESERVE UNIVERSITY (US) 2020-07-21 US disclosed
US-20180127830-A1 FLUORESCENT PROBES FOR ABASIC SITE DETECTION CASE WESTERN RESERVE UNIVERSITY 2018-05-10 US disclosed
WO-2016168467-A2 FLUORESCENT PROBES FOR ABASIC SITE DETECTION CASE WESTERN RESERVE UNIVERSITY (US) 2016-10-20 WO 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-10718028-B2 Fluorescent probes for abasic site detection OGG1, UNG, AP2B1 HDAC6 2433/4885HDAC3 2654/4885HDAC4 2387/4885
US-20180127830-A1 FLUORESCENT PROBES FOR ABASIC SITE DETECTION OGG1, UNG, AP2B1 HDAC6 2433/4885HDAC3 2654/4885HDAC4 2387/4885

“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.