SCHEMBL16057190

SCHEMBL16057190

Cc1c(-c2ccc(-c3ccccc3)nc2)ccn(C(=O)O)c1=O

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ LDHA P00338 2/20 0.43
▸ BAZ2B Q9UIF8 1/20 0.42
▸ DHODH Q02127 2/20 0.41
▸ PARP1 P09874 1/20 0.37
▸ PTPN2 P17706 1/20 0.37
▸ PTPN1 P18031 1/20 0.37
▸ HPGDS O60760 2/20 0.37
▸ ALDH1A1 P00352 2/20 0.37
▸ KDM4E B2RXH2 1/20 0.37
▸ FFAR1 O14842 1/20 0.36
▸ PDCD1 Q15116 1/20 0.35
▸ CD274 Q9NZQ7 1/20 0.35
▸ NPY5R Q15761 1/20 0.35
▸ NPC1 O15118 1/20 0.35
▸ RAB9A P51151 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL16056814 0.85 SMN1; SMN2 (0.41) HPGDSALDH1A1NPY5RNPC1RAB9A
SCHEMBL14975270 0.84 KDM4E (0.39) ALDH1A1KDM4EPDCD1CD274SMN1; SMN2
SCHEMBL16057641 0.78 MKNK1 (0.48) DHODH
SCHEMBL14975255 0.78 COMT (0.42) DHODHKDM4EPDCD1CD274
SCHEMBL16058496 0.77 HDAC4 (0.39) —
SCHEMBL16056806 0.76 LMNA (0.41) BAZ2BPTPN1ALDH1A1KDM4ERAB9A
SCHEMBL16058378 0.75 CCNC (0.38) —
SCHEMBL16056873 0.74 MCL1 (0.42) LDHAFFAR1CD274
SCHEMBL16058690 0.72 S1PR1 (0.40) ALDH1A1KDM4ERAB9ASMN1; SMN2
SCHEMBL16057309 0.70 MCL1 (0.40) ALDH1A1KDM4ENPC1RAB9ASMN1; 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-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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