SCHEMBL16058416

SCHEMBL16058416

Cc1c(-c2ccc(-c3cccnc3)cc2)ccnc1OC(=O)O

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ MKNK1 Q9BUB5 7/20 0.48
▸ MKNK2 Q9HBH9 7/20 0.48
▸ PORCN Q9H237 2/20 0.45
▸ SLC2A1 P11166 1/20 0.44
▸ PIK3CA P42336 1/20 0.43
▸ CYP3A4 P08684 2/20 0.42
▸ CYP2D6 P10635 1/20 0.41
▸ CYP19A1 P11511 1/20 0.41
▸ CYP2C9 P11712 1/20 0.41
▸ CYP2C19 P33261 1/20 0.41
▸ GPR35 Q9HC97 1/20 0.41
▸ CYP2A6 P11509 1/20 0.40
▸ PTGS2 P35354 1/20 0.40
▸ CHEK2 O96017 1/20 0.40
▸ KMO O15229 1/20 0.40
▸ NUDT1 P36639 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
SCHEMBL14975894 0.89 PORCN (0.40) PORCNPIK3CACYP3A4CYP2C9CYP2C19
SCHEMBL16057423 0.86 CCNC (0.39) PORCNPIK3CACYP3A4CYP2D6CHEK2
SCHEMBL16057338 0.82 KMO (0.44) PORCNPIK3CACYP3A4KMO
SCHEMBL16057874 0.81 LDHA (0.43) CYP3A4CYP2A6
SCHEMBL16058355 0.80 PORCN (0.41) PORCNPIK3CAKMO
SCHEMBL16056981 0.80 SLC6A7 (0.41) MKNK1MKNK2
SCHEMBL16056911 0.80 ACACB (0.35) MKNK1MKNK2CYP2C9CYP2C19
SCHEMBL16057661 0.80 SLC2A1 (0.42) PORCNSLC2A1PIK3CACYP2C9CYP2C19
SCHEMBL16058493 0.79 SMN1; SMN2 (0.41) CYP2C9CYP2C19
SCHEMBL16057040 0.79 RAB9A (0.44) MKNK1MKNK2

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-9828338-B2 Carbamate derivatives of lactam based N-acylethanolamine acid amidase (NAAA) inhibitors THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2017-11-28 — — US disclosed
US-20160068482-A1 CARBAMATE DERIVATIVES OF LACTAM BASED N-ACYLETHANOLAMINE ACID AMIDASE (NAAA) INHIBITORS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2016-03-10 — — US disclosed
WO-2014144836-A2 CARBAMATE DERIVATIVES OF LACTAM BASED N-ACYLETHANOLAMINE ACID AMIDASE (NAAA) INHIBITORS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2014-09-18 — — 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-20160068482-A1 CARBAMATE DERIVATIVES OF LACTAM BASED N-ACYLETHANOLAMINE ACID AMIDASE (NAAA) INHIBITORS NAAA, FAAH, FAAH2 MKNK1 2858/4885MKNK2 3005/4885PORCN 171/4885

“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.

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