SCHEMBL13337463

SCHEMBL13337463

NC(C(=O)NO)C(=O)Nc1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.53
HDAC1 Q13547 2/20 0.50
TAAR1 Q96RJ0 1/20 0.50
MAPT P10636 4/20 0.49
MEN1 O00255 4/20 0.49
KMT2A Q03164 4/20 0.49
ALDH1A1 P00352 3/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
GAA P10253 2/20 0.49
ATM Q13315 2/20 0.49
LMNA P02545 1/20 0.49
RXFP1 Q9HBX9 1/20 0.49
HPGD P15428 1/20 0.49
HTT P42858 1/20 0.49
TP53 P04637 1/20 0.48
EPHX1 P07099 1/20 0.48
TSHR P16473 1/20 0.48
EPHX2 P34913 1/20 0.48
CDK9 P50750 1/20 0.48
CLK4 Q9HAZ1 1/20 0.48

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
SCHEMBL22357458 0.92 POLB (0.61) POLBHDAC1TAAR1MAPTMEN1
SCHEMBL13246544 0.81 MAPT (0.62) POLBTAAR1MAPTMEN1KMT2A
SCHEMBL10942647 0.79 POLB (0.67) POLBTAAR1MAPTMEN1KMT2A
SCHEMBL11251550 0.79 GAA (0.64) POLBHDAC1TAAR1MAPTMEN1
SCHEMBL29445584 0.78 ALDH1A1 (0.59) POLBTAAR1MAPTMEN1KMT2A
SCHEMBL10368145 0.78 POLB (0.59) POLBHDAC1TAAR1MAPTMEN1
SCHEMBL4741417 0.76 TAAR1 (0.79) POLBTAAR1MAPTMEN1KMT2A
SCHEMBL8786423 0.76 POLB (0.57) POLBHDAC1TAAR1MAPTMEN1
SCHEMBL5960486 0.76 TAAR1 (0.79) POLBTAAR1MAPTMEN1KMT2A
SCHEMBL1802214 0.76 TAAR1 (0.79) POLBTAAR1MAPTMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2015126930-A2 BOOSTER DRUG THERAPY FOR MYCOBACTERIUM INFECTIONS STC.UNM (US) 2015-08-27 WO disclosed
US-7732490-B2 Methods of treating cancer MERCK HDAC RESEARCH, LLC (US) 2010-06-08 US disclosed
US-7652069-B2 Polymorphs of suberoylanilide hydroxamic acid MERCK HDAC RESEARCH, LLC (US) 2010-01-26 US disclosed
US-20080194692-A1 Polymorphs of suberoylanilide hydroxamic acid NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2008-08-14 US disclosed
US-20080119562-A1 Methods of Inducing Terminal Differentiation NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2008-05-22 US disclosed
US-20080114069-A1 Methods of inducing terminal differentiation RICHON VICTORIA M 2008-05-15 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 (3 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-20080119562-A1 Methods of Inducing Terminal Differentiation HDAC3, HDAC1, HDAC5 POLB 991/4885HDAC1 2/4885TAAR1 3927/4885
US-20080194692-A1 Polymorphs of suberoylanilide hydroxamic acid HDAC1, HDAC4, HDAC5 POLB 860/4885HDAC1 1/4885TAAR1 4646/4885
US-20080114069-A1 Methods of inducing terminal differentiation HDAC3, HDAC1, HDAC5 POLB 991/4885HDAC1 2/4885TAAR1 3927/4885

“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.