SCHEMBL2927013

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
	SCHEMBL11014169	0.82	CYP3A4 (0.48)	CYP3A4ALDH1A1THRBTSHRTP53
	SCHEMBL292270	0.73	CYP3A4 (1.00)	CYP3A4ALDH1A1THRBTSHRTP53
	SCHEMBL330561	0.73	CYP3A4 (0.65)	CYP3A4ALDH1A1THRBTSHRTP53
	SCHEMBL1353155	0.73	THRB (0.67)	CYP3A4ALDH1A1THRBTSHRTP53
	SCHEMBL9294483	0.73	TTR (0.47)	CYP3A4ALDH1A1TSHRGAAMAPK1
	SCHEMBL1392834	0.73	ALDH1A1 (0.53)	CYP3A4ALDH1A1THRBTSHRTP53
	SCHEMBL7185761	0.73	TRPV4 (0.39)	CYP3A4ALDH1A1GAAMAPK1
	SCHEMBL8840260	0.71	ALDH1A1 (0.61)	CYP3A4ALDH1A1THRBTSHRTP53
	Hydrochloric Acid SCHEMBL8840292	0.71	CYP3A4 (0.61)	CYP3A4ALDH1A1THRBTSHRTP53
	SCHEMBL28421611	0.71	CYP3A4 (0.61)	CYP3A4ALDH1A1THRBTSHRTP53

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 36 patents — showing the first 20. 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 (5 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.