SCHEMBL19111159

SCHEMBL19111159

COC(=O)c1ccc(-c2ccc(C)cc2C#CCNC(=O)OCc2ccccc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.44
RAB9A P51151 2/20 0.44
EGFR P00533 1/20 0.43
CYP3A4 P08684 7/20 0.40
TSHR P16473 3/20 0.40
LMNA P02545 2/20 0.40
GAA P10253 1/20 0.40
ALDH1A1 P00352 2/20 0.40
NPBWR1 P48145 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
MCHR1 Q99705 1/20 0.40
DHODH Q02127 1/20 0.39
NPC1 O15118 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
SCHEMBL18822177 0.93 MAPT (0.47) MAPTRAB9AEGFRCYP3A4TSHR
SCHEMBL19125730 0.90 MAPT (0.45) MAPTRAB9AEGFRCYP3A4TSHR
SCHEMBL18797914 0.85 SMN1; SMN2 (0.41) EGFRLMNAALDH1A1
SCHEMBL18822404 0.81 LMNA (0.42) MAPTLMNA
SCHEMBL7418508 0.80 MAPT (0.48) MAPTRAB9ACYP3A4TSHRLMNA
SCHEMBL19111157 0.75 MAPT (0.40) MAPTLMNAALDH1A1
SCHEMBL18822207 0.74 NAAA (0.36) MAPTLMNAALDH1A1
SCHEMBL4469807 0.73 MGLL (0.49) MAPTRAB9AEGFRLMNA
SCHEMBL15435813 0.72 KMT2A (0.45) RAB9ALMNAALDH1A1NPC1
SCHEMBL17775413 0.72 LMNA (0.41) RAB9ALMNAALDH1A1

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
US-9931379-B2 Oxyntomodulin analogs and methods of making and using same THE RESEARCH FOUNDATION FOR THE STATE UNIVERSITY OF NEW YORK (US) 2018-04-03 US disclosed
US-20170196940-A1 OXYNTOMODULIN ANALOGS AND METHODS OF MAKING AND USING SAME NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2017-07-13 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-20170196940-A1 OXYNTOMODULIN ANALOGS AND METHODS OF MAKING AND USING SAME PTMS, OGFRL1, SHBG MAPT 3705/4885RAB9A 4611/4885EGFR 1473/4885

“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.