SCHEMBL17637682

SCHEMBL17637682

CC(C)(C)CC(=O)NCc1ccc(OC(=O)Oc2ccccc2)cc1

nearest known ligand 0.58

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.58
LMNA P02545 3/20 0.53
NPC1 O15118 3/20 0.51
RAB9A P51151 2/20 0.51
KMT2A Q03164 2/20 0.49
ALDH1A1 P00352 3/20 0.47
TSHR P16473 2/20 0.47
RECQL P46063 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.46
POLB P06746 1/20 0.46
MAPK14 Q16539 1/20 0.45
MEN1 O00255 1/20 0.44

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
SCHEMBL406479 0.83 LMNA (0.71) HPGDLMNARAB9AKMT2AL3MBTL1
SCHEMBL12125388 0.81 HPGD (0.67) HPGDNPC1RAB9AKMT2AALDH1A1
SCHEMBL16192946 0.81 NPC1 (0.58) NPC1RAB9AKMT2AALDH1A1L3MBTL1
SCHEMBL26417587 0.80 HPGD (0.65) HPGDLMNANPC1RAB9AKMT2A
SCHEMBL16192934 0.76 TSHR (0.51) HPGDLMNANPC1RAB9AKMT2A
SCHEMBL14995962 0.76 HPGD (0.73) HPGDLMNANPC1RAB9AKMT2A
SCHEMBL20665546 0.76 HPGD (0.73) HPGDLMNA
SCHEMBL15562668 0.74 HPGD (1.00) HPGDLMNARAB9AKMT2AALDH1A1
SCHEMBL24431446 0.74 HPGD (0.65) HPGDLMNANPC1RAB9AALDH1A1
SCHEMBL17637645 0.74 MAPK14 (0.56) HPGDLMNANPC1RAB9AKMT2A

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-20160090351-A1 INHIBITORS OF DEUBIQUITINATING PROTEASES NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2016-03-31 US disclosed
US-20160090351-A1 INHIBITORS OF DEUBIQUITINATING PROTEASES NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2016-03-31 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-20160090351-A1 INHIBITORS OF DEUBIQUITINATING PROTEASES USP1, USP2, USP18 HPGD 2932/4885LMNA 4033/4885NPC1 3119/4885

“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.