SCHEMBL16057874

SCHEMBL16057874

Cc1c(-c2ccc(-c3ccccc3)nc2)ccnc1OC(=O)O

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ LDHA P00338 2/20 0.43
▸ BAZ2B Q9UIF8 1/20 0.42
▸ DHODH Q02127 1/20 0.39
▸ WNT3A P56704 4/20 0.38
▸ SQOR Q9Y6N5 1/20 0.38
▸ PTPN2 P17706 1/20 0.37
▸ PTPN1 P18031 1/20 0.37
▸ DGAT1 O75907 2/20 0.37
▸ PDCD1 Q15116 1/20 0.37
▸ CD274 Q9NZQ7 1/20 0.37
▸ CYP11B1 P15538 2/20 0.37
▸ CYP11B2 P19099 2/20 0.37
▸ HPGDS O60760 1/20 0.37
▸ CYP3A4 P08684 1/20 0.36
▸ CYP2A6 P11509 1/20 0.36

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 0.88 PORCN (0.40) DHODHSQORPDCD1CD274CYP3A4
SCHEMBL16058493 0.85 SMN1; SMN2 (0.41) WNT3AHPGDS
SCHEMBL16056981 0.81 SLC6A7 (0.41) DHODHPDCD1CD274
SCHEMBL16058355 0.81 PORCN (0.41) WNT3ASQORPDCD1CD274
SCHEMBL16058416 0.81 MKNK1 (0.48) CYP3A4CYP2A6
SCHEMBL16057661 0.81 SLC2A1 (0.42) LDHAWNT3ASQOR
SCHEMBL16057040 0.80 RAB9A (0.44) —
SCHEMBL16057423 0.79 CCNC (0.39) CYP3A4
SCHEMBL16058822 0.79 DHODH (0.47) DHODH
SCHEMBL16058685 0.79 LMNA (0.39) PTPN1

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 LDHA 1569/4885BAZ2B 1690/4885DHODH 2122/4885

“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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