SCHEMBL1644987

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
	SCHEMBL13945258	0.89	CYP1A2 (0.56)	CYP1B1CYP1A2CYP1A1TP53CYP19A1
	Hydrochloric Acid SCHEMBL1647048	0.88	CYP1A2 (0.55)	CYP1B1CYP1A2CYP1A1TP53CYP19A1
	SCHEMBL311324	0.86	NPC1 (0.60)	CYP1B1CYP1A2CYP1A1TP53CYP19A1
	SCHEMBL1645950	0.86	EGFR (0.54)	CYP1B1CYP1A2CYP1A1TP53CYP19A1
	SCHEMBL1644899	0.86	MAOB (0.60)	CYP1B1CYP1A2CYP1A1TP53CYP19A1
	Hydrochloric Acid SCHEMBL1647034	0.85	EGFR (0.52)	CYP1B1CYP1A2CYP1A1TP53CYP19A1
	SCHEMBL311707	0.83	TNKS (0.63)	CYP1B1CYP1A2CYP1A1TP53CYP19A1
	SCHEMBL1645853	0.83	CYP1B1 (0.46)	CYP1B1CYP1A2CYP1A1TP53CYP19A1
	SCHEMBL311674	0.83	MAOB (0.63)	CYP1B1CYP1A2CYP1A1TP53CYP19A1
	SCHEMBL311192	0.82	TNKS (0.64)	CYP1B1CYP1A2CYP1A1TNKSGABRP

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 15 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.