SCHEMBL10016510

SCHEMBL10016510

O=C(O)c1ccccc1C(=O)N1N=C(c2ccccc2)CC1c1ccccc1O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 1.00
▸ KMT2A Q03164 4/20 0.80
▸ NPSR1 Q6W5P4 3/20 0.75
▸ MEN1 O00255 3/20 0.66
▸ KDM4E B2RXH2 2/20 0.66
▸ CA1 P00915 1/20 0.64
▸ CA2 P00918 1/20 0.64
▸ MAOA P21397 2/20 0.60
▸ MAOB P27338 2/20 0.60
▸ PKM P14618 5/20 0.58
▸ TERT O14746 1/20 0.56
▸ ALDH1A1 P00352 2/20 0.55
▸ GAA P10253 1/20 0.55
▸ XBP1 P17861 1/20 0.55
▸ HTT P42858 1/20 0.55
▸ SMN1; SMN2 Q16637 1/20 0.55

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
SCHEMBL28205908 0.82 NPSR1 (0.74) POLBKMT2ANPSR1MEN1KDM4E
SCHEMBL3601300 0.75 BRAF (0.83) —
SCHEMBL3595653 0.74 BRAF (0.68) POLBPKM
SCHEMBL3638755 0.74 PKM (0.65) POLBPKM
SCHEMBL3600434 0.73 PKM (0.63) POLBPKM
SCHEMBL3586458 0.73 PKM (0.66) POLBPKM
SCHEMBL7039863 0.72 MEN1 (0.61) POLBKMT2ANPSR1MEN1KDM4E
SCHEMBL18248281 0.72 TERT (1.00) POLBKMT2ATERT
SCHEMBL14540795 0.72 NPSR1 (0.73) POLBKMT2ANPSR1MEN1CA1
SCHEMBL27918012 0.71 MAOB (0.64) POLBKMT2ANPSR1MEN1KDM4E

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140255386-A1 MICRORNA MODULATORS AND METHOD FOR IDENTIFYING AND USING THE SAME NORTH CAROLINA STATE UNIVERSITY (US) 2014-09-11 — — US disclosed
US-20140255386-A1 MICRORNA MODULATORS AND METHOD FOR IDENTIFYING AND USING THE SAME NORTH CAROLINA STATE UNIVERSITY (US) 2014-09-11 — — US disclosed
WO-2013019469-A1 MICRORNA MODULATORS AND METHOD FOR IDENTIFYING AND USING THE SAME THE WISTAR INSTITUTE (US) 2013-02-07 — — WO disclosed
US-20130023498-A1 MicroRNA Modulators and Method for Identifying and Using the Same The Wistar Institute and North Carolina State University 2013-01-24 — — US disclosed
US-20120010177-A1 MicroRNA Modulators and Method for Identifying And Using The Same The Wistar Institute / North Carolina State University (US) 2012-01-12 — — US disclosed
US-20120010177-A1 MicroRNA Modulators and Method for Identifying And Using The Same The Wistar Institute / North Carolina State University (US) 2012-01-12 — — US disclosed
US-20100196357-A1 Microrna modulators and method for identifying and using the same NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2010-08-05 — — US disclosed
US-20100196357-A1 Microrna modulators and method for identifying and using the same NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2010-08-05 — — 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 (4 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-20100196357-A1 Microrna modulators and method for identifying and using the same AGO2, RNASE1, TRDMT1 POLB 2386/4885KMT2A 1688/4885NPSR1 3040/4885
US-20130023498-A1 MicroRNA Modulators and Method for Identifying and Using the Same AGO2, RNASE1, TRDMT1 POLB 2386/4885KMT2A 1688/4885NPSR1 3040/4885
US-20120010177-A1 MicroRNA Modulators and Method for Identifying And Using The Same AGO2, RNASE1, TRDMT1 POLB 2386/4885KMT2A 1688/4885NPSR1 3040/4885
US-20140255386-A1 MICRORNA MODULATORS AND METHOD FOR IDENTIFYING AND USING THE SAME AGO2, RNASE1, TRDMT1 POLB 2386/4885KMT2A 1688/4885NPSR1 3040/4885

“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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