SCHEMBL1817023

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
	SCHEMBL11914194	0.91	ALDH1A1 (0.38)	ALDH1A1KDM4EGAACYP1A1CYP1B1
	SCHEMBL2491707	0.89	PDE4A (0.40)	ALDH1A1KDM4ECYP1A1CYP1B1CYP3A4
	SCHEMBL15171996	0.89	CYP3A4 (0.35)	ALDH1A1KDM4EGAACA1CA2
	SCHEMBL15171999	0.81	ACHE (0.36)	ALDH1A1KDM4ECYP3A4PDE4APDE4B
	SCHEMBL15172001	0.81	ACHE (0.36)	ALDH1A1KDM4ECYP3A4PDE4APDE4B
	SCHEMBL25954061	0.79	ELANE (0.46)	ALDH1A1CA1CA2ELANESMN1; SMN2
	SCHEMBL164160	0.79	ELANE (0.46)	ALDH1A1CA1CA2ELANESMN1; SMN2
	SCHEMBL8131087	0.77	KIF11 (0.44)	ALDH1A1CA1CA2CYP3A4SMN1; SMN2
	SCHEMBL30730699	0.76	CYP3A4 (0.47)	ALDH1A1KDM4EGAACYP1A1CYP1B1
	SCHEMBL25489581	0.75	ALDH1A1 (0.58)	ALDH1A1KDM4EGAACYP1A1CYP1B1

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 17 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 (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.