SCHEMBL1916440

SCHEMBL1916440

O=C(O)CCCCC1CCOCC1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM5A P29375 4/20 0.49
PHF8 Q9UPP1 4/20 0.49
KDM2A Q9Y2K7 4/20 0.49
KDM4C Q9H3R0 3/20 0.49
KDM7A Q6ZMT4 1/20 0.49
KDM4A O75164 1/20 0.45
LMNA P02545 3/20 0.44
HSD17B10 Q99714 2/20 0.44
TSHR P16473 2/20 0.44
PMP22 Q01453 2/20 0.44
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
CYP2C9 P11712 1/20 0.44
NR1I2 O75469 1/20 0.44
ALDH1A1 P00352 1/20 0.44
POLB P06746 1/20 0.44
THRB P10828 1/20 0.44
ACHE P22303 1/20 0.44
APEX1 P27695 1/20 0.44
RECQL P46063 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
SCHEMBL28992197 0.98 KDM5A (0.51) KDM5APHF8KDM2AKDM4CKDM7A
SCHEMBL27033240 0.98 KDM5A (0.51) KDM5APHF8KDM2AKDM4CKDM7A
SCHEMBL28992185 0.98 KDM5A (0.51) KDM5APHF8KDM2AKDM4CKDM7A
SCHEMBL28992209 0.98 KDM5A (0.51) KDM5APHF8KDM2AKDM4CKDM7A
SCHEMBL4170832 0.94 S1PR5 (0.43) KDM5APHF8KDM2AKDM4CKDM7A
SCHEMBL27033189 0.90 KDM5A (0.45) KDM5APHF8KDM2AKDM4CKDM7A
SCHEMBL27033108 0.87 KDM5A (0.45) KDM5APHF8KDM2AKDM4CKDM7A
SCHEMBL16116680 0.87 KDM5A (0.45) KDM5APHF8KDM2AKDM4CKDM7A
SCHEMBL27033218 0.86 S1PR5 (0.46) KDM5APHF8KDM2AKDM4CKDM7A
SCHEMBL4171831 0.85 GLA (0.41) KDM5APHF8KDM2AKDM4CKDM7A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011076734-A1 COMPOUNDS, PHARMACEUTICAL COMPOSITION AND METHODS FOR USE IN TREATING INFLAMMATORY DISEASES EUROSCREEN S.A. (BE) 2011-06-30 WO claimed
US-20110230477-A1 COMPOUNDS, PHARMACEUTICAL COMPOSITION AND METHODS FOR USE IN TREATING METABOLIC DISORDERS EUROSCREEN S.A. (BE) 2011-09-22 US disclosed
EP-1501827-A2 PIPERIDINYL-AND PIPERAZINYL-SULFONYLMETHYL HYDROXAMIC ACID AND THEIR USE AS PROTEASE INHIBITORS Pharmacia Corporation (US) 2005-02-02 EP disclosed
WO-2003091247-A2 PIPERIDINYL-AND PIPERAZINYL-SULFONYLMETHYL HYDROXAMIC ACIDS AND THEIR USE AS PROTEASE INHIBITORS PHARMACIA CORPORATION (US) 2003-11-06 WO 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-20110230477-A1 COMPOUNDS, PHARMACEUTICAL COMPOSITION AND METHODS FOR USE IN TREATING METABOLIC DISORDERS CPT1A, LIPC, PC KDM5A 3289/4885PHF8 3395/4885KDM2A 4456/4885

“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.