SCHEMBL5445874

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
	SCHEMBL5554258	0.91	PTGS2 (0.54)	AKR1C3AKR1C2LMNACYP1A2CYP2D6
	SCHEMBL5559115	0.90	PTGS2 (0.49)	AKR1C3AKR1C2PTGS1PTGS2
	SCHEMBL5554194	0.89	PTGS2 (0.55)	AKR1C3AKR1C2PTGS1PTGS2MAPT
	SCHEMBL5442566	0.89	PTGS1 (0.59)	AKR1C3AKR1C2LMNACYP1A2CYP2D6
	SCHEMBL5442372	0.89	AKR1C3 (0.72)	AKR1C3AKR1C2LMNACYP1A2CYP2D6
	SCHEMBL5560787	0.89	PTGS2 (0.49)	PTGS2
	SCHEMBL5824081	0.88	PTGS2 (0.50)	AKR1C3AKR1C2PTGS1PTGS2
	SCHEMBL5553629	0.88	PTGS2 (0.49)	AKR1C3AKR1C2PTGS2
	SCHEMBL5440977	0.88	AKR1C3 (0.62)	AKR1C3AKR1C2LMNACYP1A2CYP2D6
	SCHEMBL5558845	0.88	PTGS2 (0.51)	AKR1C3AKR1C2PTGS2

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 5 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.