SCHEMBL3772616

SCHEMBL3772616

CN1CC(N2CC3C(CNC(=O)c4cccc(C(F)(F)F)c4)C3C2)C1

nearest known ligand 0.52

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.52
POLB P06746 1/20 0.52
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
CCR2 P41597 11/20 0.49
KCNH2 Q12809 10/20 0.49
TP53BP1 Q12888 1/20 0.47

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
SCHEMBL3777123 0.93 POLB (0.56) ALDH1A1POLBMEN1KMT2ACCR2
SCHEMBL3783226 0.89 CCR2 (0.49) ALDH1A1POLBCCR2KCNH2
SCHEMBL3770723 0.87 POLB (0.57) ALDH1A1POLBMEN1KMT2ACCR2
SCHEMBL15966984 0.85 NAMPT (0.47) CCR2KCNH2
SCHEMBL29658402 0.84 POLB (0.59) ALDH1A1POLBMEN1KMT2ACCR2
SCHEMBL3776688 0.80 CCR2 (0.49) ALDH1A1POLBCCR2KCNH2
SCHEMBL5513102 0.80 POLB (0.56) ALDH1A1POLBCCR2TP53BP1
Hydrochloric Acid SCHEMBL709535 0.79 POLB (0.55) ALDH1A1POLBCCR2TP53BP1
SCHEMBL5513140 0.79 HDAC6 (0.51) ALDH1A1POLBMEN1KMT2ACCR2
SCHEMBL3778064 0.78 CACNA1H (0.43) ALDH1A1POLBKCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1869019-B1 BICYCLIC [3.1.0] HETEROARYL AMIDES AS TYPE I GLYCINE TRANSPORT INHIBITORS PFIZER PROD INC (US) 2014-08-27 EP claimed
EP-1869019-A1 BICYCLIC [3.1.0] HETEROARYL AMIDES AS TYPE I GLYCINE TRANSPORT INHIBITORS Pfizer Products Incorporated (US) 2007-12-26 EP claimed
WO-2006106425-A1 BICYCLIC [3.1.0] HETEROARYL AMIDES AS TYPE I GLYCINE TRANSPORT INHIBITORS PFIZER PRODUCTS INC. (US) 2006-10-12 WO claimed
EP-1869019-B1 BICYCLIC [3.1.0] HETEROARYL AMIDES AS TYPE I GLYCINE TRANSPORT INHIBITORS PFIZER PROD INC (US) 2014-08-27 EP disclosed
US-20100324020-A1 Bicyclic [3.1.0] Heteroaryl Amides As Type 1 Glycine Transport Inhibitors PFIZER INC. 2010-12-23 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-20100324020-A1 Bicyclic [3.1.0] Heteroaryl Amides As Type 1 Glycine Transport Inhibitors SLC1A2, SLC1A1, SLC6A5 ALDH1A1 2267/4885POLB 3782/4885MEN1 3132/4885

“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.