SCHEMBL23927494

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
	SCHEMBL373421	0.82	ALOX5 (0.46)	ALOX5PTGS2ALDH1A1CA1ESR1
	SCHEMBL881046	0.82	ALDH1A1 (0.45)	HDAC1HDAC6TAAR1ALDH1A1CA12
	SCHEMBL31248929	0.75	TAAR1 (0.39)	ALOX5PTGS2TAAR1CA12CA1
	SCHEMBL4602927	0.75	AGTR1 (0.40)	HDAC1HDAC6ALDH1A1
	SCHEMBL28872076	0.75	CYP3A4 (0.38)	HDAC1HDAC6ALDH1A1CYP3A4ALOX15
	SCHEMBL14087814	0.75	ACHE (0.43)	HDAC1HDAC6TAAR1ALDH1A1CA12
	SCHEMBL9918977	0.75	HDAC1 (0.40)	HDAC1HDAC6ALDH1A1
	SCHEMBL6797282	0.75	CYP3A4 (0.46)	ALOX5PTGS2ALDH1A1CA1ESR1
	SCHEMBL12396449	0.75	CYP3A4 (0.46)	HDAC1HDAC6TAAR1ALDH1A1CA12
	SCHEMBL12689887	0.72	HDAC1 (0.37)	HDAC1HDAC6ALDH1A1

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.