SCHEMBL2113246

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.

	Compound	similarity	top predicted	shared targets
	SCHEMBL2113102	0.85	CYP3A4 (0.48)	CYP3A4CYP2C9CYP2C19NTRK1
	SCHEMBL2112620	0.76	CYP3A4 (0.77)	CYP3A4CYP2C9CYP2C19KDRCYP1A2
	SCHEMBL2113513	0.75	CYP2C19 (0.58)	CYP3A4CYP2C9CYP2C19KDRCYP1A2
	SCHEMBL12304412	0.72	CYP3A4 (0.59)	CYP3A4CYP2C9CYP2C19KDRCYP1A2
	SCHEMBL4503728	0.71	CYP2C9 (0.60)	CYP3A4CYP2C9CYP2C19KDRCYP1A2
	SCHEMBL30368964	0.71	CYP2C9 (0.72)	CYP3A4CYP2C9CYP2C19ADORA2AKDR
	SCHEMBL2114072	0.71	CYP2C9 (0.72)	CYP3A4CYP2C9CYP2C19ADORA2AKDR
	SCHEMBL1895330	0.70	CYP3A4 (0.83)	CYP3A4CYP2C9CYP2C19KDRCYP1A2
	SCHEMBL2600023	0.70	NTRK1 (0.39)	CYP3A4CYP2C9CYP2C19NTRK1
	SCHEMBL27934700	0.69	NTRK1 (0.49)	CYP3A4CYP2C9NTRK1

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

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 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.

“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.