SCHEMBL2154698

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
	SCHEMBL7749921	0.83	ADORA1 (0.55)	NUDT1MAPK1ALDH1A1SMN1; SMN2ALOX15
	SCHEMBL2154969	0.82	NUDT1 (0.52)	NUDT1MAPK1ALDH1A1LMNAHSD17B10
	SCHEMBL7749942	0.81	PIK3CA (0.43)	NUDT1MAPK1ALDH1A1HPGDSMN1; SMN2
	SCHEMBL4278546	0.78	PIK3CA (0.60)	SMN1; SMN2TP53MAPTCYP3A4CYP2C9
	SCHEMBL10504554	0.74	MAPK1 (0.51)	NUDT1MAPK1ALDH1A1LMNAHSD17B10
	SCHEMBL30406768	0.73	IKBKB (0.55)	NUDT1MAPK1ALDH1A1LMNAHSD17B10
	SCHEMBL18484200	0.73	NUDT1 (0.43)	NUDT1MAPK1ALDH1A1CLK4DYRK1A
	SCHEMBL415754	0.72	NUDT1 (1.00)	NUDT1CLK4DYRK1A
	SCHEMBL14475137	0.72	PTK2 (0.48)	NUDT1ALDH1A1LMNACYP1A2CYP3A4
	SCHEMBL3799227	0.72	TGFBR1 (0.53)	NUDT1MAPK1LMNAHSD17B10SMN1; SMN2

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 22 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 (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.