SCHEMBL20715467

SCHEMBL20715467

CCOC(=O)c1ccc(CC(C)(C)N)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.64
CYP1A2 P05177 1/20 0.64
CYP3A4 P08684 1/20 0.64
MAOA P21397 1/20 0.64
CA1 P00915 3/20 0.56
CA2 P00918 3/20 0.56
CA12 O43570 2/20 0.56
CA7 P43166 2/20 0.56
CA9 Q16790 2/20 0.56
CA14 Q9ULX7 2/20 0.56
ESR1 P03372 1/20 0.56
ESR2 Q92731 1/20 0.56
KMT2A Q03164 3/20 0.53
SMN1; SMN2 Q16637 4/20 0.53
STS P08842 1/20 0.50
HTT P42858 5/20 0.49
RAB9A P51151 3/20 0.49
NPC1 O15118 2/20 0.49
TSHR P16473 1/20 0.49
HPGD P15428 4/20 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
SCHEMBL5831347 0.93 LMNA (0.55) LMNACYP1A2CYP3A4MAOACA1
SCHEMBL12771413 0.86 LMNA (0.62) LMNACYP1A2CYP3A4MAOACA1
SCHEMBL2406478 0.84 LMNA (0.60) LMNACYP1A2CYP3A4MAOACA1
SCHEMBL8879486 0.84 LMNA (0.56) LMNACYP1A2CYP3A4MAOACA1
SCHEMBL10661402 0.83 LOXL2 (0.62) CA1CA2CA12CA7CA9
SCHEMBL27925916 0.82 LMNA (0.57) LMNACYP1A2CYP3A4MAOACA1
SCHEMBL27667917 0.82 CA1 (0.79) LMNACYP1A2CYP3A4MAOACA1
SCHEMBL7670282 0.81 LMNA (0.53) LMNACYP1A2CYP3A4MAOACA1
SCHEMBL28245978 0.81 LMNA (0.56) LMNACYP1A2CYP3A4MAOACA1
SCHEMBL4862590 0.80 MAPT (0.51) LMNASMN1; SMN2RAB9ANPC1TSHR

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
EP-3022173-B1 COMPOUNDS FOR THE TREATMENT AND/OR PREVENTION OF PARASITIC DISEASES AND METHOD OF PRODUCTION THEREOF INSTITUT DE RECH POUR LE DEVELOPPEMENT I R D (FR) 2019-02-20 EP disclosed
US-20190040004-A1 NEW COMPOUNDS FOR THE TREATMENT AND/OR PREVENTION OF PARASITIC DISEASES AND METHOD OF PRODUCTION OF THEREOF UNIVERSITE DE MONTPELLIER (FR) 2019-02-07 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-20190040004-A1 NEW COMPOUNDS FOR THE TREATMENT AND/OR PREVENTION OF PARASITIC DISEASES AND METHOD OF PRODUCTION OF THEREOF PIGO, TTPA, TST LMNA 1706/4885CYP1A2 497/4885CYP3A4 778/4885

“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.