SCHEMBL10016348

SCHEMBL10016348

Cc1ccccc1OCCSc1nnc(C)n1-c1ccccc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.80
MAPK1 P28482 2/20 0.80
GAA P10253 2/20 0.68
ALDH1A1 P00352 5/20 0.54
KMT2A Q03164 2/20 0.54
MEN1 O00255 1/20 0.54
MAPT P10636 1/20 0.53
PDPK1 O15530 2/20 0.49
TSHR P16473 3/20 0.48
HSD17B10 Q99714 2/20 0.48
ATM Q13315 2/20 0.47
ALOX15 P16050 1/20 0.47
L3MBTL1 Q9Y468 2/20 0.47
FKBP1A P62942 1/20 0.46
NPC1 O15118 1/20 0.46
LMNA P02545 1/20 0.46
HPGD P15428 1/20 0.46
NFKB1 P19838 1/20 0.46
RAB9A P51151 1/20 0.46
NFKB2 Q00653 1/20 0.46

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
SCHEMBL12301165 0.74 L3MBTL1 (0.57) SMN1; SMN2MAPK1GAAALDH1A1KMT2A
SCHEMBL6405540 0.73 RXRA (0.71) SMN1; SMN2ALDH1A1KMT2AMEN1NPC1
SCHEMBL17153776 0.70 KDM4E (0.59) SMN1; SMN2MAPK1GAAALDH1A1KMT2A
SCHEMBL6404554 0.70 TDP1 (0.70) SMN1; SMN2ALDH1A1KMT2AMEN1MAPT
SCHEMBL1562702 0.69 ALDH1A1 (0.76) SMN1; SMN2MAPK1GAAALDH1A1KMT2A
SCHEMBL20005776 0.68 MAPT (0.55) SMN1; SMN2GAAALDH1A1KMT2AMAPT
SCHEMBL11381141 0.68 MAPT (0.47) SMN1; SMN2MAPK1GAAKMT2AMEN1
SCHEMBL6264206 0.68 KDM4E (0.56) SMN1; SMN2MAPK1GAAALDH1A1KMT2A
SCHEMBL15062005 0.67 LMNA (0.57) GAAALDH1A1KMT2AMEN1MAPT
SCHEMBL5824932 0.66 KMT2A (0.52) GAAALDH1A1KMT2AMEN1MAPT

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 9 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-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 SMN1; SMN2 3647/4885MAPK1 2787/4885GAA 1241/4885
US-20130023498-A1 MicroRNA Modulators and Method for Identifying and Using the Same AGO2, RNASE1, TRDMT1 SMN1; SMN2 3647/4885MAPK1 2787/4885GAA 1241/4885
US-20120010177-A1 MicroRNA Modulators and Method for Identifying And Using The Same AGO2, RNASE1, TRDMT1 SMN1; SMN2 3647/4885MAPK1 2787/4885GAA 1241/4885
US-20140255386-A1 MICRORNA MODULATORS AND METHOD FOR IDENTIFYING AND USING THE SAME AGO2, RNASE1, TRDMT1 SMN1; SMN2 3647/4885MAPK1 2787/4885GAA 1241/4885

“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.