SCHEMBL3979494

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
	SCHEMBL3978019	0.85	CYP1A2 (0.45)	CYP1A2CYP3A4POLBMAPTLMNA
	SCHEMBL3977995	0.85	CYP1A2 (0.52)	CYP1A2CYP3A4POLBMAPTLMNA
	SCHEMBL3986074	0.83	KMT2A (0.52)	CYP1A2MAPTLMNAHTTKMT2A
	SCHEMBL3977137	0.83	RAB9A (0.49)	CYP1A2CYP3A4POLBMAPTLMNA
	SCHEMBL3980054	0.80	KMT2A (0.51)	CYP1A2MAPTLMNAHTTKMT2A
	SCHEMBL3977311	0.80	RAB9A (0.51)	CYP1A2CYP3A4POLBMAPTLMNA
	SCHEMBL4088965	0.79	CYP1A2 (0.62)	CYP1A2CYP3A4POLBMAPTLMNA
	SCHEMBL7499552	0.79	CYP1A2 (0.47)	CYP1A2CYP3A4MAPTSLC1A3SLC1A2
	SCHEMBL3977861	0.79	KMT2A (0.50)	CYP1A2MAPTLMNAHTTKMT2A
	SCHEMBL3974891	0.79	KMT2A (0.50)	CYP1A2MAPTLMNAHTTKMT2A

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 8 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.