SCHEMBL1593629

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
	SCHEMBL15905607	0.88	CYP2C9 (0.49)	NPC1RAB9AALDH1A1GRM5RARG
	SCHEMBL12706092	0.86	GRM5 (0.48)	GRM5RARGRXRAPTGS2STIM1
	SCHEMBL1593870	0.85	ALDH1A1 (0.53)	NPC1RAB9AALDH1A1RXRASTIM1
	SCHEMBL1594146	0.85	RAB9A (0.69)	NPC1RAB9AALDH1A1PTGS2PTGS1
	SCHEMBL1594980	0.83	NQO2 (0.45)	NPC1RAB9AALDH1A1RARGRXRA
	SCHEMBL1593680	0.81	RAB9A (0.70)	NPC1RAB9AALDH1A1RXRAPTGS2
	SCHEMBL1594301	0.79	NPC1 (0.52)	NPC1RAB9AALDH1A1STIM1ORAI1
	SCHEMBL1596407	0.79	RAB9A (0.62)	NPC1RAB9AALDH1A1STIM1ORAI1
	SCHEMBL12589511	0.78	ALDH1A1 (0.69)	NPC1RAB9AALDH1A1EPHX2HSD17B1
	SCHEMBL1594109	0.77	NPC1 (0.50)	NPC1RAB9AALDH1A1CYP2C9

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 20 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.