SCHEMBL4359771

SCHEMBL4359771

CCCCCC1(CO)CC1

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GAA P10253 5/20 0.40
SIRT2 Q8IXJ6 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.39
OPRM1 P35372 1/20 0.39
OPRL1 P41146 1/20 0.39
LMNA P02545 2/20 0.38
ALDH1A1 P00352 1/20 0.38
HSD17B10 Q99714 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
TSHR P16473 1/20 0.38

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
SCHEMBL3490658 0.98 GAA (0.43) GAASIRT2LMNAALDH1A1HSD17B10
SCHEMBL2233403 0.89 SIRT2 (0.40) GAASIRT2SMN1; SMN2OPRM1OPRL1
SCHEMBL11775068 0.87 SIRT2 (0.42) GAASIRT2LMNAALDH1A1HSD17B10
SCHEMBL11607014 0.87 SIRT2 (0.42) GAASIRT2LMNAALDH1A1HSD17B10
SCHEMBL8413376 0.87 SIRT2 (0.42) GAASIRT2LMNAALDH1A1HSD17B10
SCHEMBL11773588 0.87 SIRT2 (0.42) GAASIRT2LMNAALDH1A1HSD17B10
SCHEMBL11779345 0.87 SIRT2 (0.42) GAASIRT2LMNAALDH1A1HSD17B10
SCHEMBL5805215 0.85 GAA (0.39) GAASIRT2
SCHEMBL19066498 0.84 SIRT2 (0.36) SIRT2KMT2A
SCHEMBL2807710 0.84 TSHR (0.41) GAASIRT2SMN1; SMN2LMNATSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090312558-A1 PROCESS FOR THE PREPARATION OF ARYLCYCLOPROPOANE CARBOXYLIC CARBONITRILES, AND COMPOUNDS DERIVED THEREFROM RELIANCE LIFE SCIENCES PVT. LTD. (IN) 2009-12-17 US claimed
WO-2009150660-A1 A PROCESS FOR THE PREPARATION OF ARYLCYCLOPROPANE CARBOXYLIC CARBONITRILES, AND COMPOUNDS DERIVED THEREFROM RELIANCE LIFE SCIENCES PVT. LTD. (IN) 2009-12-17 WO claimed
JP-3141233-A None JP disclosed
JP-6271484-A None JP disclosed
US-20090312558-A1 PROCESS FOR THE PREPARATION OF ARYLCYCLOPROPOANE CARBOXYLIC CARBONITRILES, AND COMPOUNDS DERIVED THEREFROM RELIANCE LIFE SCIENCES PVT. LTD. (IN) 2009-12-17 US disclosed
WO-2009150660-A1 A PROCESS FOR THE PREPARATION OF ARYLCYCLOPROPANE CARBOXYLIC CARBONITRILES, AND COMPOUNDS DERIVED THEREFROM RELIANCE LIFE SCIENCES PVT. LTD. (IN) 2009-12-17 WO disclosed
WO-2005034837-A2 7H-IMIDAZO [1,2-α] PYRAZIN-8-ONE COMPOUNDS AS ION CHANNEL MODULATORS CARDIOME PHARMA CORPORATION (US) 2005-04-21 WO disclosed
JP-H06271484-A PRODUCTION OF DIHYDRONAPHTHALENES SUMITOMO CHEM CO LTD 1994-09-27 JP disclosed
JP-H03141233-A HALONAPHTHALENE DERIVATIVE, PREPARATION AND INTERMEDIATE THEREOF SUMITOMO CHEM CO LTD 1991-06-17 JP disclosed
US-4554095-A PERFUMES INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) 1985-11-19 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-20090312558-A1 PROCESS FOR THE PREPARATION OF ARYLCYCLOPROPOANE CARBOXYLIC CARBONITRILES, AND COMPOUNDS DERIVED THEREFROM NOTUM, SULT2A1, SULT1A1 GAA 3617/4885SIRT2 3668/4885SMN1; SMN2 3522/4885

“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.