SCHEMBL10000591

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
	SCHEMBL10000589	0.79	MCL1 (0.48)	ALDH1A1NPSR1TDP1MCL1CYP1A2
	SCHEMBL3514735	0.77	ALDH1A1 (1.00)	ALDH1A1NPSR1TDP1MCL1CYP1A2
	SCHEMBL10027996	0.76	MCL1 (0.45)	ALDH1A1MCL1XDHKDM4EGAA
	SCHEMBL20561064	0.74	MCL1 (0.58)	ALDH1A1MCL1CYP1A2CYP2C19CYP2C9
	SCHEMBL31236642	0.74	MCL1 (0.58)	ALDH1A1MCL1CYP1A2CYP2C19CYP2C9
	SCHEMBL11227756	0.74	ALDH1A1 (0.57)	ALDH1A1NPSR1TDP1CYP1A2CYP2C19
	SCHEMBL17545769	0.74	MCL1 (0.58)	ALDH1A1MCL1CYP1A2CYP2C19CYP2C9
	SCHEMBL10899495	0.73	CA12 (0.44)	ALDH1A1TDP1MCL1CYP1A2CYP2C19
	SCHEMBL20594987	0.72	MCL1 (0.56)	MCL1CYP1A2CYP2C19CYP2C9CA12
	SCHEMBL16516055	0.72	L3MBTL1 (0.50)	ALDH1A1NPSR1TDP1MCL1CYP1A2

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 6 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 (2 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.