SCHEMBL10192307

SCHEMBL10192307

CCC(C)Cn1cncn1

nearest known ligand 0.42

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 2/20 0.37
EGLN3 Q9H6Z9 1/20 0.37
KMT2A Q03164 2/20 0.36
MEN1 O00255 1/20 0.36
FDPS P14324 1/20 0.34
ALDH1A1 P00352 1/20 0.34
MAPT P10636 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34

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
SCHEMBL13894764 1.00 CYP19A1 (0.37) CYP19A1EGLN3KMT2AMEN1FDPS
SCHEMBL22365186 0.90 CYP19A1 (0.34) CYP19A1EGLN3KMT2AMEN1FDPS
SCHEMBL25022444 0.84 TSHR (0.37) CYP19A1EGLN3KMT2AMEN1
SCHEMBL7467012 0.80
SCHEMBL11959513 0.79 EGLN3 (0.42) CYP19A1EGLN3KMT2AMEN1ALDH1A1
SCHEMBL10875139 0.78 CYP19A1 (0.40) CYP19A1EGLN3FDPSALDH1A1MAPT
SCHEMBL13108577 0.78 POLB (0.46) CYP19A1EGLN3FDPS
SCHEMBL12900040 0.78 POLB (0.46) CYP19A1EGLN3FDPS
SCHEMBL7470879 0.77 EGLN3 (0.37) CYP19A1EGLN3KMT2AMEN1FDPS
SCHEMBL9798169 0.77 TRPA1 (0.37) EGLN3KMT2AMEN1FDPS

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
EP-2343299-B9 Heteroaryl substituted pyrrolo[2,3-b]pyridines and pyrrolo[2,3-b]pyrimidines as Janus kinase inhibitors INCYTE HOLDINGS CORP (US) 2017-03-08 EP disclosed
US-8569512-B2 P2X3 receptor antagonists for treatment of pain MERCK SHARP & DOHME CORP. (US) 2013-10-29 US disclosed
US-20120015052-A1 P2X3 RECEPTOR ANTAGONISTS FOR TREATMENT OF PAIN MERCK SHARP & DOHME LLC 2012-01-19 US disclosed
US-20100266714-A1 P2X3 RECEPTOR ANTAGONISTS FOR TREATMENT OF PAIN MERCK SHARP & DOHME LLC 2010-10-21 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 (2 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-20100266714-A1 P2X3 RECEPTOR ANTAGONISTS FOR TREATMENT OF PAIN P2RX3, P2RX1, P2RX2 CYP19A1 4780/4885EGLN3 1000/4885KMT2A 4191/4885
US-20120015052-A1 P2X3 RECEPTOR ANTAGONISTS FOR TREATMENT OF PAIN P2RX3, P2RX1, P2RX2 CYP19A1 4780/4885EGLN3 1000/4885KMT2A 4191/4885

“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.