SCHEMBL6506969

SCHEMBL6506969

CCOc1ccc(CN2CC3C(CNc4ccc(N5CCOCC5)c(F)c4)C3C2)cc1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.50
KDM4E B2RXH2 2/20 0.50
GAA P10253 1/20 0.50
CACNA1B Q00975 1/20 0.47
APBA1 Q02410 1/20 0.47
SAE1 Q9UBE0 1/20 0.47
UBA2 Q9UBT2 1/20 0.47
MAPT P10636 4/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
POLB P06746 2/20 0.41
HSD17B10 Q99714 1/20 0.41
L3MBTL1 Q9Y468 2/20 0.40
MTOR P42345 1/20 0.40
HRH3 Q9Y5N1 1/20 0.39
TP53 P04637 1/20 0.39
ALDH2 P05091 1/20 0.38
NPY2R P49146 1/20 0.38
LMNA P02545 1/20 0.38

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
SCHEMBL4413306 0.93 L3MBTL1 (0.49) ALDH1A1KDM4EGAACACNA1BAPBA1
SCHEMBL4415239 0.91 SMN1; SMN2 (0.46) KDM4EMAPTSMN1; SMN2L3MBTL1ALDH2
SCHEMBL2179983 0.91 KDM4E (0.42) ALDH1A1KDM4EGAACACNA1BAPBA1
SCHEMBL4412123 0.90 L3MBTL1 (0.41) ALDH1A1GAAMAPTSMN1; SMN2HSD17B10
SCHEMBL4424935 0.90 PDK1 (0.43) ALDH1A1KDM4EGAACACNA1BAPBA1
SCHEMBL4418914 0.89 ALDH1A1 (0.45) ALDH1A1KDM4EGAAMAPTSMN1; SMN2
SCHEMBL4422665 0.89 GAA (0.39) ALDH1A1KDM4EGAACACNA1BAPBA1
SCHEMBL4415737 0.89 P2RX3 (0.39) ALDH1A1KDM4EGAAHSD17B10L3MBTL1
SCHEMBL2170676 0.88 LMNA (0.44) ALDH1A1GAAMAPTSMN1; SMN2POLB
SCHEMBL4412370 0.88 L3MBTL1 (0.44) GAAMAPTSMN1; SMN2L3MBTL1TP53

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
EP-1680124-B1 BICYCLIC [3.1.0] DERIVATIVES AS GLYCINE TRANSPORTER INHIBITORS PFIZER PROD INC (US) 2017-05-31 EP claimed
US-20050096375-A1 Bicyclic [3.1.0] derivatives as glycine transporter inhibitors PFIZER INC. 2005-05-05 US claimed
EP-1680124-B1 BICYCLIC [3.1.0] DERIVATIVES AS GLYCINE TRANSPORTER INHIBITORS PFIZER PROD INC (US) 2017-05-31 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-20050096375-A1 Bicyclic [3.1.0] derivatives as glycine transporter inhibitors SLC6A5, SLC1A5, SLC6A3 ALDH1A1 3166/4885KDM4E 2032/4885GAA 1239/4885

“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.