SCHEMBL10870

SCHEMBL10870

O=C(CCI)N1CCOCC1

nearest known ligand 0.55

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.55
TSHR P16473 3/20 0.53
POLB P06746 3/20 0.53
GLA P06280 1/20 0.53
LMNA P02545 1/20 0.53
FKBP1A P62942 2/20 0.51
ALDH1A1 P00352 1/20 0.51
ALOX15 P16050 2/20 0.50
HSD17B10 Q99714 2/20 0.50
RAB9A P51151 3/20 0.49
MEN1 O00255 1/20 0.48
TP53 P04637 1/20 0.48
KMT2A Q03164 1/20 0.48
SMN1; SMN2 Q16637 4/20 0.47
NPC1 O15118 1/20 0.47
USP2 O75604 1/20 0.47
ATM Q13315 1/20 0.46
GAA P10253 2/20 0.46

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
SCHEMBL5778349 0.84 L3MBTL1 (0.57) L3MBTL1TSHRPOLBGLALMNA
SCHEMBL28413664 0.84 GLA (0.56) L3MBTL1TSHRPOLBGLALMNA
SCHEMBL2262931 0.84 L3MBTL1 (0.61) L3MBTL1TSHRPOLBGLALMNA
SCHEMBL9415751 0.82 GLA (0.67) L3MBTL1TSHRPOLBGLALMNA
SCHEMBL14041701 0.81 ATM (0.68) L3MBTL1LMNAALDH1A1HSD17B10RAB9A
SCHEMBL5451707 0.81 GLA (0.61) L3MBTL1TSHRPOLBGLALMNA
SCHEMBL19574225 0.81 ATM (0.75) L3MBTL1TSHRPOLBGLALMNA
SCHEMBL7694058 0.80 GLA (0.65) L3MBTL1TSHRPOLBGLALMNA
SCHEMBL3404224 0.80 L3MBTL1 (0.63) L3MBTL1TSHRPOLBGLALMNA
SCHEMBL423999 0.79 L3MBTL1 (0.61) L3MBTL1TSHRPOLBGLALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3150609-A1 PROCESS FOR PREPARING CERTAIN CHEMICAL ENTITIES Intellikine, LLC (US) 2017-04-05 EP disclosed
WO-2014071109-A1 TREATMENT OF CANCERS USING PI3 KINASE ISOFORM MODULATORS INFINITY PHARMACEUTICALS, INC. (US) 2014-05-08 WO disclosed
WO-2014004470-A1 TREATMENT OF LUPUS, FIBROTIC CONDITIONS, AND INFLAMMATORY MYOPATHIES AND OTHER DISORDERS USING PI3 KINASE INHIBITORS INFINITY PHARMACEUTICALS, INC. (US) 2014-01-03 WO disclosed
US-8067454-B2 Thio-substituted Anthra [1, 2-d] imidazole- 6, 11-dione derivatives, preparation method and application thereof NATIONAL DEFENSE MEDICAL CENTER (TW) 2011-11-29 US disclosed
US-20110207727-A1 Thio-subsituted Anthra [1, 2-d] imidazole- 6, 11-dione Dervatives, Preparation Method and application thereof NATIONAL DEFENSE MEDICAL CENTER (TW) 2011-08-25 US disclosed
WO-2011048936-A1 AMINOTHIAZOLE DERIVATIVE 大正製薬株式会社 (JP) 2011-04-28 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-20110207727-A1 Thio-subsituted Anthra [1, 2-d] imidazole- 6, 11-dione Dervatives, Preparation Method and application thereof TERT, ACIN1, TERF2 L3MBTL1 3662/4885TSHR 790/4885POLB 834/4885

“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.