SCHEMBL4773542

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
	SCHEMBL15775696	0.85	TNKS (0.57)	PARP1CCNB2CDK1CCNB1CCNB3
	SCHEMBL8602417	0.83	ADORA2A (0.59)	PARP1CCNB2CDK1CCNB1CCNB3
	SCHEMBL15775264	0.82	RIPK1 (0.52)	PARP1RIPK1TNKSTNKS2NPC1
	SCHEMBL15775722	0.82	CCNB2 (0.55)	PARP1CCNB2CDK1CCNB1CCNB3
	SCHEMBL15775563	0.82	PARP1 (0.56)	PARP1CCNB2CDK1CCNB1CCNB3
	SCHEMBL15775268	0.82	CCNB2 (0.55)	PARP1CCNB2CDK1CCNB1CCNB3
	SCHEMBL4765770	0.78	RIPK1 (0.67)	PARP1CCNB2CDK1CCNB1CCNB3
	SCHEMBL15775369	0.78	TNKS (0.59)	PARP1CCNB2CDK1CCNB1CCNB3
	SCHEMBL7913613	0.78	ADORA2A (0.70)	CCNB2CDK1CCNB1CCNB3GSK3A
	SCHEMBL30472919	0.78	ADORA2A (0.70)	CCNB2CDK1CCNB1CCNB3GSK3A

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 9 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.