SCHEMBL6478595

SCHEMBL6478595

CC(C)(C)OC(=O)Nc1ccc(C=O)cc1NC(=O)OC(C)(C)C

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.44
KCNQ4 P56696 3/20 0.43
KCNQ5 Q9NR82 3/20 0.43
MIF P14174 1/20 0.42
NPC1 O15118 1/20 0.41
RECQL P46063 1/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
KDM4E B2RXH2 1/20 0.41
HDAC3 O15379 1/20 0.41
HDAC1 Q13547 1/20 0.41
HDAC2 Q92769 1/20 0.41
HDAC8 Q9BY41 1/20 0.41
HDAC6 Q9UBN7 1/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
MAPT P10636 1/20 0.40
CYP17A1 P05093 2/20 0.39
CA12 O43570 1/20 0.39

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
SCHEMBL10281753 0.89 HPGD (0.45) HPGDKCNQ4KCNQ5MIFNPC1
SCHEMBL29955982 0.88 ALDH1A1 (0.44) HPGDKCNQ4KCNQ5MIFNPC1
SCHEMBL5164739 0.88 SMN1; SMN2 (0.44) HPGDMIFNPC1RECQLRAB9A
SCHEMBL29954082 0.88 ALDH1A1 (0.44) HPGDMIFNPC1RECQLRAB9A
SCHEMBL11999997 0.88 CA12 (0.43) HPGDMIFNPC1RECQLRAB9A
SCHEMBL29951650 0.87 ALDH1A1 (0.42) MIFNPC1RECQLRAB9ASMN1; SMN2
SCHEMBL29953638 0.87 BRAF (0.43) KCNQ4KCNQ5MIFNPC1RECQL
SCHEMBL19944782 0.87 ALDH1A1 (0.42) MIFNPC1RECQLRAB9ASMN1; SMN2
SCHEMBL6336273 0.87 CYP17A1 (0.50) KCNQ4KCNQ5MIFNPC1RECQL
SCHEMBL18002664 0.87 NPC1 (0.45) MIFNPC1RECQLRAB9ASMN1; SMN2

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-6861530-B2 Piperidine derivatives KYOWA HAKKO KOGYO CO., LTD. (JP) 2005-03-01 US disclosed
US-6492392-B1 INHIBITING TUMOR CELL PROLIFERATION KYOWA HAKKO KOGYO CO., LTD. (JP) 2002-12-10 US disclosed
US-20020137770-A1 Piperidine derivatives KYOWA HAKKO KOGYO CO., LTD. (JP) 2002-09-26 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-20020137770-A1 Piperidine derivatives CIP2A, PARP2, TP53 HPGD 659/4885KCNQ4 2730/4885KCNQ5 2061/4885

“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.