SCHEMBL21664002

SCHEMBL21664002

Fc1ccccc1C1=NCCS1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NISCH Q9Y2I1 1/20 0.44
ALDH1A1 P00352 4/20 0.38
MAPT P10636 2/20 0.38
HPGD P15428 2/20 0.38
POLB P06746 2/20 0.38
KDM4E B2RXH2 1/20 0.38
LMNA P02545 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
DCUN1D1 Q96GG9 1/20 0.37
MPL P40238 1/20 0.37
EED O75530 1/20 0.36
PTAFR P25105 1/20 0.36
HDAC8 Q9BY41 1/20 0.36
ATM Q13315 1/20 0.35
NOTUM Q6P988 1/20 0.34
IDO1 P14902 1/20 0.34

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
SCHEMBL21664130 0.78 SMN1; SMN2 (0.41) ALDH1A1MAPTHPGDPOLBLMNA
SCHEMBL11559376 0.77 ALDH1A1 (0.44) ALDH1A1MAPTPOLBKDM4ELMNA
SCHEMBL25584892 0.77 NISCH (0.44) NISCHALDH1A1MAPTPOLBKDM4E
SCHEMBL1030121 0.77 HTR2B (0.46) ALDH1A1HPGDPOLBLMNASMN1; SMN2
SCHEMBL894671 0.76 POLB (0.37) NISCHALDH1A1MAPTPOLBLMNA
SCHEMBL21663994 0.73 MAPT (0.45) NISCHALDH1A1MAPTHPGDPOLB
SCHEMBL27701214 0.73 ALDH1A1 (0.38) ALDH1A1MAPTPOLBLMNASMN1; SMN2
SCHEMBL1147751 0.71 LMNA (0.53) ALDH1A1MAPTPOLBLMNASMN1; SMN2
SCHEMBL27985018 0.70 MAOA (0.40) ALDH1A1MAPTPOLBKDM4ELMNA
SCHEMBL27995612 0.69 ALDH1A1 (0.38) NISCHALDH1A1MAPTPOLBKDM4E

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11319347-B2 Peptide compound and method for producing same, composition for screening use, and method for selecting peptide compound FUJIFILM CORPORATION (JP) 2022-05-03 US disclosed
US-20200040039-A1 PEPTIDE COMPOUND AND METHOD FOR PRODUCING SAME, COMPOSITION FOR SCREENING USE, AND METHOD FOR SELECTING PEPTIDE COMPOUND FUJIFILM CORPORATION (JP) 2020-02-06 US disclosed
CN-1259942-A Novel guanidine mimics as factor Xa inhibitors DU PONT MERCK PHARMA (US) 2000-07-12 CN 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 (2 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-20200040039-A1 PEPTIDE COMPOUND AND METHOD FOR PRODUCING SAME, COMPOSITION FOR SCREENING USE, AND METHOD FOR SELECTING PEPTIDE COMPOUND VIP, NPPA, NGLY1 NISCH 1116/4885ALDH1A1 4809/4885MAPT 3979/4885
US-11319347-B2 Peptide compound and method for producing same, composition for screening use, and method for selecting peptide compound VIP, NPPA, NGLY1 NISCH 1116/4885ALDH1A1 4809/4885MAPT 3979/4885

“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.