SCHEMBL9407986

SCHEMBL9407986

COC(=O)[C@H]1CC[C@H](c2nnc(-c3ccc(N4CCN(C(=O)OC(C)(C)C)CC4)cc3)s2)CC1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 9/20 0.47
MAPT P10636 4/20 0.44
LMNA P02545 2/20 0.44
ALDH1A1 P00352 1/20 0.44
ALOX5 P09917 1/20 0.44
SMN1; SMN2 Q16637 4/20 0.43
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
CYP2C19 P33261 1/20 0.42
HTT P42858 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
TSHR P16473 1/20 0.42
PTPN2 P17706 1/20 0.41
PTPN1 P18031 1/20 0.41
PTPN6 P29350 1/20 0.41
NAMPT P43490 1/20 0.41
DDB1 Q16531 1/20 0.41
CRBN Q96SW2 1/20 0.41

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
SCHEMBL9408156 0.88 GPR119 (0.47) GPR119HTTPTPN2PTPN1PTPN6
SCHEMBL9407978 0.88 GPR119 (0.47) GPR119HTTPTPN2PTPN1PTPN6
SCHEMBL13099208 0.83 MAPT (0.42) MAPTSMN1; SMN2MEN1KMT2A
Hydrochloric Acid SCHEMBL9408126 0.82 MAPT (0.41) MAPTSMN1; SMN2MEN1KMT2A
SCHEMBL3101680 0.82 MAPT (0.43) MAPTALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL13099112 0.80 DRD2 (0.44) MAPTALDH1A1TSHR
SCHEMBL13098780 0.80 MAPT (0.41) MAPTALDH1A1SMN1; SMN2MEN1KMT2A
SCHEMBL13099111 0.79 USP2 (0.41) MAPTLMNAALDH1A1SMN1; SMN2HTT
SCHEMBL6538550 0.79 GPR119 (0.55) GPR119MAPTHTTPTPN2PTPN1
SCHEMBL9407954 0.79 GPR119 (0.45) GPR119LMNAALDH1A1SMN1; SMN2MEN1

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-20100256048-A1 POLYPEPTIDE COMPOUND ASTELLAS PHARMA INC. (JP) 2010-10-07 US disclosed
US-20100256048-A1 POLYPEPTIDE COMPOUND ASTELLAS PHARMA INC. (JP) 2010-10-07 US disclosed
EP-0608858-A1 5-Membered heterocycles as aggregation inhibitors Dr. Karl Thomae GmbH (DE) 1994-08-03 EP 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-20100256048-A1 POLYPEPTIDE COMPOUND VIP, ANPEP, NPEPPS GPR119 1593/4885MAPT 3126/4885LMNA 3162/4885

“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.