SCHEMBL19909758

SCHEMBL19909758

CCN[C@H]1CC[C@@H](C(=O)OCC)CC1

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.47
ALDH1A1 P00352 6/20 0.45
TSHR P16473 2/20 0.44
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
KDM4E B2RXH2 1/20 0.43
GAA P10253 1/20 0.41
PPM1B O75688 1/20 0.41
PTPN1 P18031 1/20 0.41
PPP1CC P36873 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41

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
SCHEMBL4222468 1.00 MAPT (0.47) MAPTALDH1A1TSHRMEN1KMT2A
SCHEMBL19893800 1.00 MAPT (0.47) MAPTALDH1A1TSHRMEN1KMT2A
Hydrochloric Acid SCHEMBL19893793 0.98 MAPT (0.46) MAPTALDH1A1TSHRMEN1KMT2A
Hydrochloric Acid SCHEMBL19893791 0.98 MAPT (0.46) MAPTALDH1A1TSHRMEN1KMT2A
SCHEMBL5009722 0.86 MAPT (0.45) MAPTALDH1A1TSHRMEN1KMT2A
SCHEMBL1722155 0.85 GAA (0.44) ALDH1A1GAAPPM1BPTPN1PPP1CC
SCHEMBL1722156 0.85 GAA (0.44) ALDH1A1GAAPPM1BPTPN1PPP1CC
SCHEMBL1701062 0.85 MAPT (0.50) MAPTALDH1A1TSHRMEN1KMT2A
SCHEMBL379473 0.84 MAPT (0.44) MAPTALDH1A1TSHRMEN1KMT2A
SCHEMBL8891623 0.84 MAPT (0.60) MAPTALDH1A1MEN1KMT2APPM1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10189804-B2 Method for producing dicarboxylic acid compound DAIICHI SANKYO COMPANY, LIMITED (JP) 2019-01-29 US disclosed
US-20180148424-A1 METHOD FOR PRODUCING DICARBOXYLIC ACID COMPOUND DAIICHI SANKYO COMPANY, LIMITED (JP) 2018-05-31 US disclosed
US-20180148424-A1 METHOD FOR PRODUCING DICARBOXYLIC ACID COMPOUND DAIICHI SANKYO COMPANY, LIMITED (JP) 2018-05-31 US disclosed
EP-3287448-A1 METHOD FOR PRODUCING DICARBOXYLIC ACID COMPOUND DAIICHI SANKYO COMPANY, LIMITED (JP) 2018-02-28 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 (2 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-10189804-B2 Method for producing dicarboxylic acid compound PC, CPS1, PCCA MAPT 3033/4885ALDH1A1 294/4885TSHR 3294/4885
US-20180148424-A1 METHOD FOR PRODUCING DICARBOXYLIC ACID COMPOUND PC, CPS1, PCCA MAPT 3033/4885ALDH1A1 294/4885TSHR 3294/4885

“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.