SCHEMBL4112012

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
	SCHEMBL4116705	0.85	NOTUM (0.55)	GRM5NOTUMMAPTMEN1KMT2A
	SCHEMBL4105538	0.85	ALDH1A1 (0.53)	TAS1R3TAS1R1TAS1R2GRM5NOTUM
	SCHEMBL4111987	0.85	NPC1 (0.56)	TAS1R3TAS1R1TAS1R2GRM5NOTUM
	SCHEMBL4106020	0.82	NPC1 (0.58)	TAS1R3TAS1R1TAS1R2GRM5NOTUM
	SCHEMBL4124894	0.81	TAS1R3 (0.60)	TAS1R3TAS1R1TAS1R2NOTUMMAPT
	SCHEMBL4106025	0.80	RAB9A (0.56)	GRM5NOTUMMAPTMEN1KMT2A
	SCHEMBL4110501	0.80	RAB9A (0.57)	TAS1R3TAS1R1TAS1R2GRM5NOTUM
	SCHEMBL4106224	0.78	NPC1 (0.48)	TAS1R3TAS1R1TAS1R2GRM5MEN1
	SCHEMBL4105991	0.78	NPC1 (0.56)	GRM5NOTUMMAPTMEN1KMT2A
	SCHEMBL4119191	0.78	RAB9A (0.56)	TAS1R3TAS1R1TAS1R2NOTUMMAPT

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 6 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.