SCHEMBL3784958

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
	SCHEMBL5841896	0.90	TDP1 (0.54)	NTRK1ABL1ALDH1A1KDM4EUSP2
	SCHEMBL23525668	0.89	ERN1 (0.48)	NTRK1CHEK1DAPK3JAK2ABL1
	SCHEMBL2185228	0.89	AGPAT2 (0.49)	NTRK1ALDH1A1KDM4EUSP2MAPT
	SCHEMBL5843621	0.89	FYN (0.46)	NTRK1ALDH1A1KDM4EUSP2MAPT
	SCHEMBL654302	0.88	PTGDR2 (0.57)	NTRK1ALDH1A1KDM4EUSP2MAPT
	SCHEMBL27185972	0.87	ALDH1A1 (0.55)	ALDH1A1KDM4EUSP2MAPTGAA
	Hydrochloric Acid SCHEMBL654301	0.86	PTGDR2 (0.55)	NTRK1ALDH1A1KDM4EUSP2MAPT
	SCHEMBL2783622	0.86	DHFR (0.55)	NTRK1CHEK1DAPK3JAK2ABL1
	SCHEMBL2784662	0.86	ALDH1A1 (0.55)	NTRK1CHEK1DAPK3JAK2ABL1
	SCHEMBL3841305	0.86	CYP19A1 (0.47)	NTRK1CHEK1DAPK3JAK2ABL1

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 2 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.