SCHEMBL4964872

SCHEMBL4964872

O=C(NC1CCC(O)CC1)C1(c2ccc(Cl)cc2)CC1

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HDAC4 P56524 1/20 0.51
AVPR1A P37288 7/20 0.50
NPC1 O15118 1/20 0.50
RAB9A P51151 1/20 0.50
LMNA P02545 2/20 0.49
HSD11B1 P28845 8/20 0.48
KCNH2 Q12809 1/20 0.46
OXTR P30559 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.45
IDO1 P14902 1/20 0.44

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
SCHEMBL25464591 0.88 HDAC4 (0.67) HDAC4AVPR1ALMNAHSD11B1IDO1
SCHEMBL25464152 0.87 HDAC4 (0.65) HDAC4AVPR1ALMNAHSD11B1IDO1
SCHEMBL4961970 0.87 POLB (0.57) HDAC4AVPR1ANPC1RAB9AHSD11B1
SCHEMBL25464156 0.84 IDO1 (0.54) HDAC4AVPR1ALMNAHSD11B1KCNH2
SCHEMBL25464161 0.84 HDAC4 (0.65) HDAC4AVPR1ANPC1RAB9AHSD11B1
SCHEMBL4963699 0.79 IDO1 (0.52) HDAC4AVPR1ALMNAHSD11B1KCNH2
Bromide SCHEMBL2096326 0.78 AVPR1A (0.69) HDAC4AVPR1ALMNAHSD11B1KCNH2
Bromide SCHEMBL2096328 0.78 AVPR1A (0.69) HDAC4AVPR1ALMNAHSD11B1KCNH2
SCHEMBL31045652 0.78 AVPR1A (0.44) HDAC4AVPR1ALMNAHSD11B1KCNH2
SCHEMBL6408662 0.77 HDAC4 (0.52) HDAC4AVPR1ALMNAHSD11B1KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1773780-A4 AMIDO COMPOUNDS AND THEIR USE AS PHARMACEUTICALS INCYTE CORP (US) 2008-01-09 EP claimed
EP-1773780-A2 AMIDO COMPOUNDS AND THEIR USE AS PHARMACEUTICALS Incyte Corporation (US) 2007-04-18 EP claimed
WO-2006012227-A2 AMIDO COMPOUNDS AND THEIR USE AS PHARMACEUTICALS INCYTE CORPORATION (US) 2006-02-02 WO claimed
US-20050288338-A1 Amido compounds and their use as pharmaceuticals INCYTE CORPORATION 2005-12-29 US claimed
EP-1773780-A4 AMIDO COMPOUNDS AND THEIR USE AS PHARMACEUTICALS INCYTE CORP (US) 2008-01-09 EP disclosed
EP-1773780-A2 AMIDO COMPOUNDS AND THEIR USE AS PHARMACEUTICALS Incyte Corporation (US) 2007-04-18 EP disclosed
WO-2006012227-A2 AMIDO COMPOUNDS AND THEIR USE AS PHARMACEUTICALS INCYTE CORPORATION (US) 2006-02-02 WO disclosed
US-20050288338-A1 Amido compounds and their use as pharmaceuticals INCYTE CORPORATION 2005-12-29 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-20050288338-A1 Amido compounds and their use as pharmaceuticals HSD11B1, CYP11B1, HSD11B2 HDAC4 1710/4885AVPR1A 57/4885NPC1 383/4885

“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.