SCHEMBL171528

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
	SCHEMBL13490595	0.82	RET (0.46)	RETHPGDSCYP2D6ALDH1A1DRD2
	SCHEMBL13490730	0.81	JAK2 (0.50)	CYP2D6CYP3A4CYP2C19MEN1NPC1
	SCHEMBL13490598	0.81	CYP2D6 (0.51)	RETHPGDSCYP2D6ALDH1A1DRD2
	SCHEMBL171620	0.79	HPGDS (0.55)	RETHPGDSALDH1A1DRD2DRD4
	SCHEMBL13490731	0.79	ALDH1A1 (0.47)	RETHPGDSCYP2D6ALDH1A1DRD2
	SCHEMBL13490427	0.78	CYP2D6 (0.48)	RETHPGDSCYP2D6ALDH1A1DRD2
	SCHEMBL13490597	0.78	HRH2 (0.56)	RETHPGDSCYP2D6ALDH1A1CYP3A4
	SCHEMBL13490514	0.77	CYP3A4 (0.58)	HPGDSCYP2D6ALDH1A1DRD2DRD4
	SCHEMBL171680	0.76	DRD2 (0.61)	RETHPGDSALDH1A1DRD2DRD4
	SCHEMBL13490600	0.76	ALDH1A1 (0.49)	RETHPGDSCYP2D6ALDH1A1CYP3A4

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.

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.

“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.