SCHEMBL6028219

SCHEMBL6028219

CC(C)(C)OC(=O)NCC1CCC(C(=O)N2CCN(C(=O)OCc3ccccc3)CC2)CC1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.53
HTT P42858 1/20 0.52
KDM4E B2RXH2 1/20 0.51
PKM P14618 1/20 0.51
SMN1; SMN2 Q16637 3/20 0.50
NPC1 O15118 2/20 0.50
RAB9A P51151 2/20 0.50
GRIN2B Q13224 5/20 0.49
DRD2 P14416 2/20 0.49
CYP2D6 P10635 3/20 0.48
CYP2C9 P11712 3/20 0.48
CYP3A4 P08684 2/20 0.48
CYP2C19 P33261 1/20 0.48
CKS1B P61024 1/20 0.48
SKP1 P63208 1/20 0.48
SKP2 Q13309 1/20 0.48
NAPEPLD Q6IQ20 1/20 0.46
TPSAB1 Q15661 1/20 0.46
TPSD1 Q9BZJ3 1/20 0.46
TPSG1 Q9NRR2 1/20 0.46

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
SCHEMBL5351275 0.90 KDM4E (0.62) HTTKDM4EPKMSMN1; SMN2NPC1
SCHEMBL31333958 0.88 DRD2 (0.59) HTTKDM4EPKMSMN1; SMN2NPC1
SCHEMBL25232232 0.86 KDM4E (0.58) HTTKDM4EPKMSMN1; SMN2NPC1
SCHEMBL31334376 0.84 SMN1; SMN2 (0.57) ALDH1A1HTTKDM4ESMN1; SMN2NPC1
SCHEMBL31333438 0.84 KDM4E (0.56) HTTKDM4EPKMSMN1; SMN2NPC1
SCHEMBL31617924 0.83 NAMPT (0.56) HTTKDM4EPKMSMN1; SMN2NPC1
SCHEMBL6981012 0.83 SMN1; SMN2 (0.65) ALDH1A1HTTKDM4EPKMSMN1; SMN2
SCHEMBL1939593 0.83 SMN1; SMN2 (0.65) ALDH1A1HTTKDM4EPKMSMN1; SMN2
SCHEMBL13668666 0.83 SYK (0.57) DRD2CYP2C9CYP3A4CKS1BSKP1
SCHEMBL13666981 0.83 SYK (0.57) DRD2CYP2C9CYP3A4CKS1BSKP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7015325-B2 Tryptase inhibitors ALTANA PHARMA AG (DE) 2006-03-21 US disclosed
US-6960588-B1 Tryptase inhibitors ALTANA PHARMA AG (DE) 2005-11-01 US disclosed
EP-1244643-B1 TRYPTASE INHIBITORS ALTANA PHARMA AG (DE) 2004-06-16 EP disclosed
US-20030083344-A1 Tryptase inhibitors ALTANA PHARMA AG (DE) 2003-05-01 US disclosed
EP-1244643-A1 TRYPTASE INHIBITORS ALTANA Pharma AG (DE) 2002-10-02 EP disclosed
EP-1216236-A1 TRYPTASE INHIBITORS Byk Gulden Lomberg Chemische Fabrik GmbH (DE) 2002-06-26 EP disclosed
WO-2001046168-A1 TRYPTASE INHIBITORS BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) 2001-06-28 WO disclosed
WO-2001019809-A1 TRYPTASE INHIBITORS BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) 2001-03-22 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 (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-20030083344-A1 Tryptase inhibitors TPSAB1, TPSB2, TPSG1 ALDH1A1 779/4885HTT 2669/4885KDM4E 2476/4885

“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.