SCHEMBL7127567

SCHEMBL7127567

Clc1ccc(C2=NCCCN2)cn1

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
NISCH Q9Y2I1 8/20 0.56
GAA P10253 1/20 0.54
TSHR P16473 1/20 0.54
PDCD1LG2 Q9BQ51 1/20 0.54
CD274 Q9NZQ7 1/20 0.54
TOP2A P11388 4/20 0.53
TOP2B Q02880 4/20 0.53
LMNA P02545 1/20 0.49
RECQL P46063 1/20 0.49
POLB P06746 1/20 0.43
CYP2A6 P11509 1/20 0.42

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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.

Compoundsimilaritytop predictedshared targets
SCHEMBL7011598 0.90 PDCD1LG2 (0.64) NISCHPDCD1LG2CD274TOP2ATOP2B
SCHEMBL3058419 0.80 NISCH (0.56) NISCHGAATSHRPDCD1LG2CD274
SCHEMBL13327264 0.80 NISCH (0.81) NISCHGAATSHRTOP2ATOP2B
SCHEMBL20036352 0.76 NISCH (0.51) NISCHGAATSHRPDCD1LG2CD274
SCHEMBL20036346 0.76 NISCH (0.51) NISCHGAATSHRPDCD1LG2CD274
SCHEMBL5141529 0.72 NISCH (0.80) NISCHGAATSHRTOP2ATOP2B
SCHEMBL11462790 0.72 NISCH (1.00) NISCHGAATSHRTOP2ATOP2B
SCHEMBL31249900 0.72 NISCH (0.68) NISCHGAATSHRTOP2ATOP2B
SCHEMBL2513540 0.72 NISCH (0.68) NISCHGAATSHRTOP2ATOP2B
SCHEMBL4035056 0.72 NISCH (0.68) NISCHGAATSHRTOP2ATOP2B

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.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030100769-A1 Cyclic amidine compounds DAIICHI SUNTORY PHARMA CO., LTD. (JP) 2003-05-29 US claimed
US-20030100769-A1 Cyclic amidine compounds DAIICHI SUNTORY PHARMA CO., LTD. (JP) 2003-05-29 US disclosed

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.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030100769-A1 Cyclic amidine compounds CHRM1, CHRM5, CCKAR NISCH 1691/4885GAA 4427/4885TSHR 31/4885

“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.