SCHEMBL16433685

SCHEMBL16433685

CCOCc1nc(CC)no1

nearest known ligand 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.34
HSD17B10 Q99714 2/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
TSHR P16473 2/20 0.32
KDM4E B2RXH2 1/20 0.31
ALOX15 P16050 1/20 0.31
APOBEC3A P31941 1/20 0.31
APOBEC3G Q9HC16 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
MAPK1 P28482 2/20 0.31
MEN1 O00255 1/20 0.31
LMNA P02545 1/20 0.31
KMT2A Q03164 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
SCN5A Q14524 1/20 0.30

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
SCHEMBL10116209 0.85 MAPT (0.39) MAPTHSD17B10CYP2C9CYP2C19SMN1; SMN2
SCHEMBL18066924 0.82 GBA1 (0.32) MAPTHSD17B10CYP2C9CYP2C19SMN1; SMN2
SCHEMBL10103787 0.82 SMN1; SMN2 (0.32) MAPTHSD17B10CYP2C9CYP2C19SMN1; SMN2
SCHEMBL14584998 0.82 MAPK1 (0.41) MAPTHSD17B10CYP2C9CYP2C19SMN1; SMN2
SCHEMBL12705 0.78
SCHEMBL15492423 0.78 MAPT (0.56) MAPTHSD17B10CYP2C9CYP2C19SMN1; SMN2
SCHEMBL22540946 0.77 MAPT (0.33) MAPTHSD17B10CYP2C9CYP2C19SMN1; SMN2
SCHEMBL10263561 0.74 HSD17B10 (0.36) MAPTHSD17B10CYP2C9CYP2C19SMN1; SMN2
SCHEMBL15490001 0.73 HSD11B1 (0.33) MAPTHSD17B10CYP2C9CYP2C19SMN1; SMN2
SCHEMBL10264412 0.73 MAPT (0.54) MAPTSMN1; SMN2TSHRKDM4EL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220194932-A1 IMPROVED INHIBITORS OF THE NOTCH TRANSCRIPTIONAL ACTIVATION COMPLEX AND METHODS FOR USE OF THE SAME STEMSYNERGY THERAPEUTICS, INC. 2022-06-23 US disclosed
EP-2410858-B1 P2X3 RECEPTOR ANTAGONISTS FOR TREATMENT OF PAIN MERCK SHARP & DOHME (US) 2016-09-07 EP disclosed
US-8946231-B2 P2X3, receptor antagonists for treatment of pain MERCK SHARP & DOHME CORP. (US) 2015-02-03 US disclosed
US-8247401-B2 P2X3 receptor antagonists for treatment of pain MERCK SHARP & DOHME CORP. (US) 2012-08-21 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-20220194932-A1 IMPROVED INHIBITORS OF THE NOTCH TRANSCRIPTIONAL ACTIVATION COMPLEX AND METHODS FOR USE OF THE SAME NOTCH1, CBFB, HES1 MAPT 3977/4885HSD17B10 2096/4885CYP2C9 3999/4885

“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.