SCHEMBL1038440

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
	SCHEMBL1037286	0.88	PARP1 (0.42)	MAP2K1ROCK1ROCK2PRKCDPRKACA
	SCHEMBL745351	0.81	MAP2K1 (0.54)	MAP2K1ROCK1ROCK2PRKCDPRKACA
	SCHEMBL5256175	0.80	MAP2K1 (0.48)	MAP2K1ROCK1ROCK2PRKCDPRKACA
	SCHEMBL8938683	0.78	MAP2K1 (0.60)	MAP2K1ROCK1ROCK2PRKCDPRKACA
	SCHEMBL1544837	0.78	LTA4H (0.60)	HDAC1LTA4H
	SCHEMBL8938638	0.77	MAP2K1 (0.63)	MAP2K1ROCK1ROCK2PRKCDPRKACA
	SCHEMBL8934693	0.77	ROCK1 (0.61)	MAP2K1ROCK1ROCK2PRKCDPRKACA
	SCHEMBL8934691	0.76	ROCK1 (0.64)	MAP2K1ROCK1ROCK2PRKCDPRKACA
	SCHEMBL11939496	0.76	LTA4H (0.55)	MAP2K1ROCK1ROCK2PRKCDPRKACA
	SCHEMBL374997	0.76	ROCK1 (0.56)	MAP2K1ROCK1ROCK2PRKCDPRKACA

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 24 patents — showing the first 20. 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 (12 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.