SCHEMBL2643958

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
	SCHEMBL645986	0.90	ALDH1A1 (0.41)	ALDH1A1LMNASMN1; SMN2HTTGCK
	SCHEMBL643275	0.88	PTGS2 (0.41)	ALDH1A1GCKDAGLAABHD6RXRA
	SCHEMBL2644098	0.86	GCK (0.40)	ALDH1A1LMNASMN1; SMN2HTTGCK
	SCHEMBL2645878	0.85	GCK (0.49)	ALDH1A1SMN1; SMN2GCKDAGLAABHD6
	SCHEMBL2644255	0.84	GCK (0.39)	ALDH1A1GCKDAGLAABHD6RXRA
	SCHEMBL642785	0.84	ALDH1A1 (0.46)	ALDH1A1SMN1; SMN2GCKRXRAKDM4E
	SCHEMBL2643952	0.83	GCK (0.39)	ALDH1A1GCKDAGLARXRAKDM4E
	SCHEMBL2645247	0.83	GCK (0.44)	ALDH1A1LMNASMN1; SMN2HTTGCK
	SCHEMBL643433	0.81	GCK (0.52)	LMNAGCKTSHR
	SCHEMBL644281	0.81	GCK (0.64)	GCK

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 7 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 (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.