SCHEMBL995091

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
	SCHEMBL30966592	1.00	ALDH1A1 (0.52)	ALDH1A1MAPK1TP53MAPTRXFP1
	SCHEMBL27630911	0.88	TP53 (0.44)	ALDH1A1MAPK1TP53MAPTRXFP1
	SCHEMBL2020140	0.86	ABL1 (0.59)	ALDH1A1TP53BRD4CYP1A1CYP1A2
	SCHEMBL5858581	0.85	CYP1A1 (0.53)	ALDH1A1TP53MAPTBRD4CYP1A1
	SCHEMBL364849	0.85	ABL1 (0.63)	ALDH1A1MAPK1TP53MAPTRXFP1
	SCHEMBL3455245	0.82	ABL1 (0.60)	ALDH1A1MAPK1TP53BRD4CYP1A1
	SCHEMBL13211663	0.82	ABL1 (0.60)	ALDH1A1BRD4CYP1A1CYP1A2CYP2E1
	SCHEMBL21290362	0.82	TP53 (0.53)	TP53MAPTRXFP1DYRK1ACLK4
	SCHEMBL24860576	0.82	GSTP1 (0.59)	ALDH1A1MAPK1MAPTCYP1A2CYP3A4
	SCHEMBL8613956	0.80	CYP1A1 (0.50)	ALDH1A1TP53MAPTBRD4CYP1A1

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 22 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 (4 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.