SCHEMBL95594

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
	SCHEMBL28251333	0.78	ALDH1A1 (0.53)	ALDH1A1TDP1KDM4ECYP3A4MAPT
	SCHEMBL2090982	0.78	CA12 (0.65)	ALDH1A1CYP3A4MAPTNFE2L2CA1
	SCHEMBL2089114	0.78	CA12 (0.65)	ALDH1A1CYP3A4MAPTNFE2L2CA1
	SCHEMBL1276533	0.76	CYP3A4 (0.59)	ALDH1A1TSHRTDP1KDM4ECYP3A4
	SCHEMBL97370	0.75	CA1 (0.62)	ALDH1A1TSHRTDP1CA1CA2
	SCHEMBL95360	0.75	CA2 (0.61)	ALDH1A1TSHRCYP3A4CA1CA2
	SCHEMBL2119031	0.72	ALDH1A1 (0.43)	ALDH1A1TSHRTDP1KDM4ECYP3A4
	SCHEMBL2093197	0.72	ACHE (0.48)	ALDH1A1KDM4ECYP3A4MAPTCA9
	SCHEMBL3192136	0.72	CYP1A2 (0.43)	ALDH1A1KDM4ECYP3A4CA1CA2
	SCHEMBL7013645	0.71	HIF1A (0.49)	ALDH1A1TSHRKDM4EMAPTCA1

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 11 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 (3 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.