SCHEMBL20133828

SCHEMBL20133828

CC(C)C(=S)NC(=O)Cc1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.56
LMNA P02545 2/20 0.56
POLB P06746 3/20 0.55
MEN1 O00255 2/20 0.53
KMT2A Q03164 2/20 0.53
CYP1A2 P05177 1/20 0.53
HDAC8 Q9BY41 1/20 0.52
HDAC6 Q9UBN7 1/20 0.52
GAA P10253 3/20 0.50
CNR2 P34972 2/20 0.50
CRHBP P24387 1/20 0.50
NPBWR1 P48145 1/20 0.50
CRHR2 Q13324 1/20 0.50
MCHR1 Q99705 1/20 0.50
RAB9A P51151 1/20 0.50
MAPT P10636 2/20 0.49
TDP1 Q9NUW8 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
EPHX2 P34913 1/20 0.49

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
SCHEMBL14817549 0.80 ALDH1A1 (0.61) ALDH1A1LMNAPOLBMEN1KMT2A
SCHEMBL2605818 0.80 POLB (0.56) ALDH1A1LMNAPOLBMEN1KMT2A
SCHEMBL699925 0.79 MEN1 (0.71) ALDH1A1LMNAMEN1KMT2AHDAC8
SCHEMBL16587378 0.78 MEN1 (0.59) ALDH1A1LMNAPOLBMEN1KMT2A
SCHEMBL10202166 0.77 ALDH1A1 (0.58) ALDH1A1LMNAPOLBMEN1KMT2A
SCHEMBL171909 0.77 CRHBP (0.58) ALDH1A1LMNAPOLBMEN1KMT2A
SCHEMBL3565748 0.77 ALDH1A1 (0.57) ALDH1A1LMNAPOLBMEN1KMT2A
SCHEMBL16672173 0.76 POLB (0.55) ALDH1A1LMNAPOLBMEN1KMT2A
SCHEMBL13664094 0.76 ALDH1A1 (0.56) ALDH1A1LMNAPOLBMEN1KMT2A
SCHEMBL16431179 0.76 MEN1 (0.52) ALDH1A1LMNAPOLBMEN1KMT2A

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-20180125848-A1 PREPARATION AND METHODS OF USE FOR ORTHO-ARYL 5-MEMBERED HETEROARYL-CARBOXAMIDE CONTAINING MULTI-TARGETED KINASE INHIBITORS VIBLIOME THERAPEUTICS, LLC 2018-05-10 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-20180125848-A1 PREPARATION AND METHODS OF USE FOR ORTHO-ARYL 5-MEMBERED HETEROARYL-CARBOXAMIDE CONTAINING MULTI-TARGETED KINASE INHIBITORS ABL1, ERBB2, MAP3K2 ALDH1A1 3761/4885LMNA 4217/4885POLB 1683/4885

“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.