SCHEMBL91654

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
	SCHEMBL71690	0.88	TAS1R3 (0.39)	MAPTKMT2AALDH1A1MEN1CYP3A4
	SCHEMBL91649	0.80	TAS1R3 (0.47)	HRH3KDM4EMAPTHPGDKMT2A
	SCHEMBL16329467	0.73	CA12 (0.51)	KDM4EMAPTKMT2AALDH1A1MEN1
	SCHEMBL24611299	0.71	HRH3 (0.40)	HRH3DRD3ADRB2ADRB1ADRB3
	SCHEMBL30935750	0.69	NPC1 (0.49)	HRH3DRD3ADRB2ADRB1ADRB3
	SCHEMBL26497867	0.69	NPC1 (0.49)	HRH3DRD3ADRB2ADRB1ADRB3
	SCHEMBL71831	0.69	CYP3A4 (0.40)	HRH3ADRB2ADRB1ADRB3KDM4E
	SCHEMBL9610298	0.69	MTNR1A (0.35)	HRH3KDM4EMAPTHPGDKMT2A
	SCHEMBL4590567	0.69	PTPN11 (0.53)	KDM4EMAPTHPGDKMT2AALDH1A1
	SCHEMBL12376761	0.69	HRH3 (0.38)	HRH3DRD3ADRB2ADRB1ADRB3

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 4 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 (1 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.