SCHEMBL21710487

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
	SCHEMBL21717834	0.92	CA1 (0.40)	CA1CA2PGRMAP4K4MEN1
	SCHEMBL21717829	0.89	CA1 (0.38)	CA1CA2ALDH1A3PGRMAP4K4
	SCHEMBL21710589	0.89	CA1 (0.47)	CA1CA2CYP1A2ALDH1A1CYP3A4
	SCHEMBL21718143	0.86	ENPP3 (0.41)	ALDH1A3PGRMAP4K4ADORA2ACYP1A2
	SCHEMBL21718134	0.86	PTGES (0.35)	CA1CA2CYP1A2ALDH1A1CYP3A4
	SCHEMBL22858105	0.86	PTGES (0.35)	CA1CA2CYP1A2ALDH1A1CYP3A4
	SCHEMBL21717347	0.86	MAP4K4 (0.43)	ALDH1A3PGRMAP4K4ADORA2ACYP1A2
	SCHEMBL21717396	0.85	CA1 (0.34)	CA1CA2CYP1A2ALDH1A1CYP3A4
	SCHEMBL22858086	0.85	PTGES (0.35)	CA1CA2CYP1A2ALDH1A1LMNA
	SCHEMBL21710485	0.83	HPRT1 (0.36)	CYP1A2ALDH1A1CYP3A4LMNACYP2C19

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 7 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.