SCHEMBL6406461

SCHEMBL6406461

COc1ccc(COCC2C(C)C2C(=O)O)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FABP7 O15540 1/20 0.49
FABP5 Q01469 1/20 0.49
NPC1 O15118 1/20 0.46
POLB P06746 1/20 0.46
RAB9A P51151 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
FFAR1 O14842 1/20 0.43
HTT P42858 2/20 0.43
LDHA P00338 1/20 0.43
CTBP2 P56545 1/20 0.42
EDNRA P25101 2/20 0.41
EDNRB P24530 1/20 0.41
PLA2G4B P0C869 1/20 0.41
IDO1 P14902 1/20 0.40
AGXT P21549 1/20 0.40
ALDH1A1 P00352 2/20 0.40
HDAC4 P56524 1/20 0.40
HDAC6 Q9UBN7 1/20 0.40

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
SCHEMBL6415827 0.87 HTT (0.45) FABP7FABP5NPC1POLBRAB9A
SCHEMBL20517351 0.85 FABP7 (0.44) FABP7FABP5SMN1; SMN2CA1CA2
SCHEMBL6412245 0.85 FABP7 (0.44) FABP7FABP5SMN1; SMN2CA1CA2
SCHEMBL5502688 0.84 FABP7 (0.48) FABP7FABP5NPC1POLBRAB9A
SCHEMBL3952761 0.84 FABP7 (0.48) FABP7FABP5NPC1POLBRAB9A
SCHEMBL6407087 0.84 FABP7 (0.45) FABP7FABP5NPC1POLBRAB9A
SCHEMBL6414765 0.83 NAAA (0.43) NPC1RAB9AFFAR1HTTIDO1
SCHEMBL6408787 0.83 L3MBTL1 (0.42) FABP7FABP5NPC1POLBRAB9A
SCHEMBL6411945 0.79 CACNA1B (0.43) FABP7FABP5NPC1RAB9ASMN1; SMN2
SCHEMBL6408753 0.76 SLC6A11 (0.45) FABP7FABP5CA1CA2EDNRA

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-20050288526-A1 Process for production of 2-(hydroxymethyl)cyclo-propanecarboxylic acids SUMITOMO CHEMICAL COMPAY LIMTED (JP) 2005-12-29 US disclosed
EP-1538141-A1 PROCESS FOR PRODUCTION OF 2-(HYDROXYMETHYL)CYCLO- PROPANECARBOXYLIC ACIDS Sumitomo Chemical Company, Limited (JP) 2005-06-08 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-20050288526-A1 Process for production of 2-(hydroxymethyl)cyclo-propanecarboxylic acids GRHPR, PCCA, C5 FABP7 4846/4885FABP5 4727/4885NPC1 4011/4885

“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.