SCHEMBL97779

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
	SCHEMBL6210974	0.89	PARP1 (0.51)	PARP1HTR2AHTR2C
	SCHEMBL9784026	0.83	PARP1 (0.33)	PARP1TSHR
	SCHEMBL30188261	0.82	PARP1 (0.38)	PARP1HTR1ATSHR
	SCHEMBL4695076	0.82	PARP1 (0.38)	PARP1HTR1ATSHR
	Acetonitrile SCHEMBL28877477	0.78	PARP1 (0.35)	PARP1HTR1ATSHRDRD2
	SCHEMBL95812	0.78	TSHR (0.33)	PARP1TSHR
	SCHEMBL4847695	0.77	CREBBP (0.39)	PARP1HTR1ATSHR
	SCHEMBL29952627	0.73	PARP1 (0.42)	PARP1HTR1ATSHRCLK1DYRK1A
	SCHEMBL894456	0.73	PARP1 (0.42)	PARP1HTR1ATSHRCLK1DYRK1A
	SCHEMBL9868543	0.72	NOTUM (0.38)	—

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 11 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.