SCHEMBL15068895

SCHEMBL15068895

CCCCc1c(N2CCCC2)c2c(CO)cccc2oc1=O

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.46
LMNA P02545 2/20 0.46
KMT2A Q03164 2/20 0.46
MEN1 O00255 1/20 0.45
TSHR P16473 1/20 0.45
HTT P42858 1/20 0.45
HSD17B10 Q99714 1/20 0.45
BRAF P15056 9/20 0.44
MAPT P10636 1/20 0.41
AGTR1 P30556 1/20 0.41
GAA P10253 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
SCHEMBL15068420 0.93 ALDH1A1 (0.47) ALDH1A1LMNAKMT2AMEN1TSHR
SCHEMBL15068746 0.88 ALDH1A1 (0.49) ALDH1A1LMNAKMT2AMEN1TSHR
SCHEMBL15068516 0.71 CCR4 (0.41) ALDH1A1LMNAKMT2AMEN1TSHR
SCHEMBL15068896 0.70 BRAF (0.43) ALDH1A1LMNAKMT2AMEN1TSHR
SCHEMBL10791670 0.66 HSD17B3 (0.44) ALDH1A1LMNAHTTMAPT
SCHEMBL15068641 0.66 MAPT (0.46) ALDH1A1LMNAKMT2AMEN1TSHR
SCHEMBL15068894 0.65 KMT2A (0.41) ALDH1A1LMNAKMT2AMEN1TSHR
SCHEMBL15069249 0.65 GAA (0.49) ALDH1A1LMNAKMT2AMEN1TSHR
SCHEMBL10791535 0.65 MAPT (0.46) ALDH1A1LMNAHTTMAPT
SCHEMBL10790406 0.64 SRC (0.51) ALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-RE47689-E1 Compounds for treating spinal muscular atrophy PTC THERAPEUTICS, INC. (US) 2019-11-05 US disclosed
US-9617268-B2 Compounds for treating spinal muscular atrophy PTC THERAPEUTICS, INC. (US) 2017-04-11 US disclosed
US-20150119380-A1 COMPOUNDS FOR TREATING SPINAL MUSCULAR ATROPHY F. HOFFMANN-LA ROCHE AG (CH) 2015-04-30 US disclosed
EP-2797592-A1 COMPOUNDS FOR TREATING SPINAL MUSCULAR ATROPHY PTC Therapeutics, Inc. (US) 2014-11-05 EP disclosed
WO-2013101974-A1 COMPOUNDS FOR TREATING SPINAL MUSCULAR ATROPHY PTC THERAPEUTICS, INC. (US) 2013-07-04 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-20150119380-A1 COMPOUNDS FOR TREATING SPINAL MUSCULAR ATROPHY SMN1; SMN2, RBM17, RBM22 ALDH1A1 1006/4885LMNA 251/4885KMT2A 413/4885

“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.