SCHEMBL4431017

SCHEMBL4431017

CCc1ccc(CN2CC3C(CNc4ccc(N5CCN(C(C)=O)CC5)c(F)c4)C3C2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.45
ALDH1A1 P00352 4/20 0.45
KDM4E B2RXH2 3/20 0.45
MEN1 O00255 3/20 0.45
KMT2A Q03164 3/20 0.45
GAA P10253 2/20 0.45
ALOX15 P16050 2/20 0.45
ALOX12 P18054 2/20 0.45
GFER P55789 2/20 0.45
HSP90AA1 P07900 1/20 0.45
HSP90AB1 P08238 1/20 0.45
TSHR P16473 1/20 0.45
MAPK1 P28482 1/20 0.45
HTT P42858 1/20 0.45
HSD17B10 Q99714 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
MAOB P27338 2/20 0.41
MAOA P21397 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.40
LMNA P02545 1/20 0.40

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
SCHEMBL2204766 0.97 MAPT (0.43) MAPTALDH1A1KDM4EMEN1KMT2A
SCHEMBL4425265 0.88 KDM4E (0.42) MAPTALDH1A1KDM4ESMN1; SMN2LMNA
SCHEMBL4431016 0.85 MAPT (0.43) MAPTALDH1A1KDM4EMEN1KMT2A
SCHEMBL4412123 0.85 L3MBTL1 (0.41) MAPTALDH1A1KMT2AGAAALOX15
SCHEMBL2204760 0.82 MAPT (0.41) MAPTALDH1A1KDM4EMEN1KMT2A
SCHEMBL4414369 0.82 L3MBTL1 (0.47) MAPTALDH1A1KDM4EKMT2AGAA
SCHEMBL4421406 0.78 NPC1 (0.47) MAPTALDH1A1MEN1KMT2AGAA
SCHEMBL2170676 0.77 LMNA (0.44) MAPTALDH1A1KMT2AGAAHTT
SCHEMBL4417596 0.77 GAA (0.42) MAPTALDH1A1KDM4EKMT2AGAA
SCHEMBL4417595 0.77 S1PR1 (0.36) MAPTALDH1A1KDM4EGAAHTT

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 disclosed
US-7473787-B2 Bicyclic [3.1.0] derivatives as glycine transporter inhibitors PFIZER INC (US) 2009-01-06 US disclosed
US-20050096375-A1 Bicyclic [3.1.0] derivatives as glycine transporter inhibitors PFIZER INC. 2005-05-05 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-20050096375-A1 Bicyclic [3.1.0] derivatives as glycine transporter inhibitors SLC6A5, SLC1A5, SLC6A3 MAPT 1368/4885ALDH1A1 3166/4885KDM4E 2032/4885

“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.