SCHEMBL710104

SCHEMBL710104

O=C(NCC1C2CNCC21)c1cc(C(F)(F)F)ccc1F

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DDR1 Q08345 1/20 0.45
LIPC P11150 1/20 0.41
LIPG Q9Y5X9 1/20 0.41
SSTR4 P31391 1/20 0.40
EPHX2 P34913 1/20 0.40
MEN1 O00255 1/20 0.39
TSHR P16473 1/20 0.39
KMT2A Q03164 1/20 0.39
SORT1 Q99523 1/20 0.39
CCR2 P41597 3/20 0.38
PARP1 P09874 1/20 0.38
GPR52 Q9Y2T5 1/20 0.38
LMNA P02545 2/20 0.38
TP53 P04637 2/20 0.38
MAPT P10636 2/20 0.38
TMPRSS4 Q9NRS4 1/20 0.38
TRPV1 Q8NER1 1/20 0.38
CHRM2 P08172 1/20 0.37
CHRM4 P08173 1/20 0.37
CHRM5 P08912 1/20 0.37

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
SCHEMBL5513102 0.79 POLB (0.56) CCR2LMNATP53CHRM3
SCHEMBL5512193 0.78 NPC1 (0.40) SSTR4CHRM1
Hydrochloric Acid SCHEMBL709535 0.78 POLB (0.55) CCR2LMNATP53CHRM3
SCHEMBL708326 0.78 TAS1R3 (0.50) EPHX2
SCHEMBL29242150 0.77 RPS6KB1 (0.48) LIPCLIPGEPHX2SORT1CHRM2
Hydrochloric Acid SCHEMBL711109 0.77 TAS1R3 (0.49) EPHX2
SCHEMBL5518294 0.76 L3MBTL1 (0.48) KMT2ATP53MAPTCHRM1
SCHEMBL710113 0.76 KCNH2 (0.46) DDR1
SCHEMBL13753003 0.76 DDR1 (0.58) DDR1EPHX2SORT1LMNATMPRSS4
SCHEMBL5513291 0.75 LMNA (0.51) SSTR4LMNACHRM4CHRM5CHRM3

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 7 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-8124639-B2 Bicyclic [3.1.0] heteroaryl amides as type 1 glycine transport inhibitors PFIZER INC. (US) 2012-02-28 US disclosed
US-20100324020-A1 Bicyclic [3.1.0] Heteroaryl Amides As Type 1 Glycine Transport Inhibitors PFIZER INC. 2010-12-23 US disclosed
US-20060229455-A1 Bicyclic [3.1.0.] heteroaryl amides as type 1 glycine transport inhibitors PFIZER INC. 2006-10-12 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 (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-20100324020-A1 Bicyclic [3.1.0] Heteroaryl Amides As Type 1 Glycine Transport Inhibitors SLC1A2, SLC1A1, SLC6A5 DDR1 4706/4885LIPC 1869/4885LIPG 4373/4885
US-20060229455-A1 Bicyclic [3.1.0.] heteroaryl amides as type 1 glycine transport inhibitors SLC1A2, SLC1A1, GLRA1 DDR1 4642/4885LIPC 1990/4885LIPG 4332/4885

“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.