Water

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
	SCHEMBL1170754	0.93	ITGB1 (0.49)	ITGB1ITGA4KDM1ABCHEACHE
	SCHEMBL2434296	0.82	ITGB1 (0.52)	ITGB1ITGA4KDM1ABCHEACHE
	Water SCHEMBL1170416	0.79	ITGB1 (0.44)	ITGB1ITGA4KDM1ABCHEACHE
	SCHEMBL2432149	0.78	ITGB1 (0.53)	ITGB1ITGA4KDM1ABCHEACHE
	SCHEMBL2433469	0.78	ITGB1 (0.44)	ITGB1ITGA4KDM1AALDH1A1KMT2A
	SCHEMBL2431945	0.76	ITGB1 (0.52)	ITGB1ITGA4KDM1ABCHEACHE
	SCHEMBL2430239	0.75	ITGB1 (0.59)	ITGB1ITGA4KDM1AALDH1A1ACKR3
	SCHEMBL2432754	0.75	ITGB1 (0.66)	ITGB1ITGA4KDM1ABCHEACHE
	SCHEMBL2433766	0.72	ITGB1 (0.54)	ITGB1ITGA4KDM1ABCHEACHE
	SCHEMBL2434775	0.71	ITGB1 (0.58)	ITGB1ITGA4KDM1AALDH1A1ACKR3

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 (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.