SCHEMBL7044014

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
	SCHEMBL7044012	0.90	ALDH1A1 (0.38)	ALDH1A1LMNAGAAKMT2AMEN1
	SCHEMBL7042230	0.82	CYP3A4 (0.34)	ALDH1A1LMNAKMT2AMEN1NPSR1
	SCHEMBL6523558	0.82	TDP1 (0.40)	ALDH1A1LMNAGAAKMT2AMEN1
	SCHEMBL7041600	0.81	CYP3A4 (0.42)	ALDH1A1LMNAKMT2AMEN1NPSR1
	SCHEMBL6518880	0.72	GAA (0.51)	ALDH1A1LMNAGAAKMT2AMEN1
	SCHEMBL7039622	0.72	ALDH1A1 (0.41)	ALDH1A1LMNANPSR1CYP1A2CYP3A4
	SCHEMBL7042380	0.72	SLC6A2 (0.42)	ALDH1A1LMNAGAAKMT2AMEN1
	SCHEMBL7041596	0.72	KEAP1 (0.40)	ALDH1A1LMNAKMT2AMEN1NPSR1
	SCHEMBL6513746	0.71	GAA (0.50)	ALDH1A1LMNAGAAKMT2AMEN1
	SCHEMBL7041594	0.71	ALDH1A1 (0.35)	ALDH1A1LMNAGAAKMT2AMEN1

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 1 patent. 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 (1 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.