SCHEMBL10130807

SCHEMBL10130807

CCCC(=O)C1CCN(C(C)=O)CC1

nearest known ligand 0.43

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TGM2 P21980 1/20 0.41
ABL1 P00519 1/20 0.41
RIN1 Q13671 1/20 0.41
EPHX2 P34913 5/20 0.40
EPHX1 P07099 1/20 0.40
GAA P10253 1/20 0.40
CYP1A2 P05177 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
REV1 Q9UBZ9 2/20 0.38
MAPT P10636 3/20 0.38
GNAI3 P08754 1/20 0.37
GNAO1 P09471 1/20 0.37
GNAI1 P63096 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
SCHEMBL31348822 0.85 ABL1 (0.44) TGM2ABL1RIN1GAAMAPT
SCHEMBL12922885 0.84 EPHX2 (0.42) EPHX2EPHX1GAACYP1A2TDP1
SCHEMBL18701859 0.80 TGM2 (0.39) TGM2ABL1RIN1GAAMAPT
SCHEMBL24694382 0.80 EPHX2 (0.42) EPHX2EPHX1GAACYP1A2TDP1
SCHEMBL10074020 0.80 GNAI3 (0.44) TGM2ABL1RIN1GNAI3GNAO1
SCHEMBL18711894 0.79 SPR (0.39) EPHX2EPHX1CYP1A2TDP1
SCHEMBL4712321 0.79
SCHEMBL190471 0.78 EPHX2 (0.41) EPHX2EPHX1GAACYP1A2TDP1
SCHEMBL24694438 0.78 EPHX2 (0.41) EPHX2EPHX1GAACYP1A2TDP1
SCHEMBL19450813 0.78 EPHX2 (0.41) EPHX2EPHX1GAACYP1A2TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170096435-A1 SEPIAPTERIN REDUCTASE INHIBITORS MAX-PLANCK-GESELLSCHAFT ZUR FOERDERUNG DER WISSENSCHAFTEN E.V. (DE) 2017-04-06 US disclosed
EP-1820503-B1 Aminoindazole derivatives active as kinase inhibitors, process for their preparation and pharmaceutical compositions containing them PFIZER ITALIA SRL (IT) 2012-02-22 EP 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-20170096435-A1 SEPIAPTERIN REDUCTASE INHIBITORS SPR, QDPR, SRR TGM2 1899/4885ABL1 4678/4885RIN1 3303/4885

“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.