SCHEMBL433630

SCHEMBL433630

CC1(C)OC(=O)C(=C(c2ccc(O)cc2)C2CC2)C(=O)O1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.42
LMNA P02545 3/20 0.42
GAA P10253 1/20 0.42
SMN1; SMN2 Q16637 2/20 0.39
PTPN1 P18031 4/20 0.37
ALDH1A1 P00352 5/20 0.35
CYP1A2 P05177 2/20 0.35
CYP3A4 P08684 2/20 0.35
SIRT1 Q96EB6 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.33
CYP2C9 P11712 2/20 0.32
MAPK1 P28482 2/20 0.32
KMT2A Q03164 2/20 0.32
BACE1 P56817 1/20 0.32
ACP1 P24666 2/20 0.32
CDC25B P30305 2/20 0.32
ESR2 Q92731 4/20 0.32
ESR1 P03372 3/20 0.31
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.31

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
SCHEMBL13548786 0.70 LMNA (0.42) MAPTLMNAGAASMN1; SMN2PTPN1
SCHEMBL2803500 0.70 PTPN1 (0.46) MAPTLMNAGAAPTPN1ALDH1A1
SCHEMBL435198 0.64 SIRT1 (0.71) MAPTLMNAGAASMN1; SMN2ALDH1A1
SCHEMBL9190067 0.62 PTPN1 (0.46) LMNASMN1; SMN2PTPN1ALDH1A1MAPK1
SCHEMBL13885529 0.61 ALDH1A1 (0.46) MAPTLMNAPTPN1ALDH1A1CYP1A2
SCHEMBL1334195 0.61 MGLL (0.57) MAPTLMNAKMT2AESR2ESR1
SCHEMBL5370523 0.61 MGLL (0.57) MAPTLMNAKMT2AESR2ESR1
SCHEMBL5370517 0.61 MGLL (0.57) MAPTLMNAKMT2AESR2ESR1
SCHEMBL70825 0.60 PTPN1 (0.56) MAPTLMNAGAASMN1; SMN2PTPN1
SCHEMBL2472619 0.59 MAPT (0.57) MAPTLMNAGAASMN1; SMN2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2595952-B1 AGONISTS OF GPR40 CONNEXIOS LIFE SCIENCES PVT LTD (IN) 2020-11-18 EP disclosed
US-9290603-B2 Amines having secondary aliphatic amino groups SIKA TECHNOLOGY AG (CH) 2016-03-22 US disclosed
US-9278915-B2 Agonists of GPR40 CONNEXIOS LIFE SCIENCES PVT LTD (IN) 2016-03-08 US disclosed
US-20130237681-A1 AMINES HAVING SECONDARY ALIPHATIC AMINO GROUPS SIKA TECHNOLOGY AG (CH) 2013-09-12 US disclosed
US-20130237571-A1 AGONISTS OF GPR40 Conexios Life Sciences PVT. LTD. (IN) 2013-09-12 US disclosed
EP-2595952-A1 AGONISTS OF GPR40 Connexios Life Sciences Pvt. Ltd. (IN) 2013-05-29 EP disclosed
WO-2012011125-A1 AGONISTS OF GPR40 CONNEXIOS LIFE SCIENCES PVT. LTD. (IN) 2012-01-26 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 (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-20130237571-A1 AGONISTS OF GPR40 GPR65, GPR55, GPR68 MAPT 2792/4885LMNA 3516/4885GAA 1970/4885
US-20130237681-A1 AMINES HAVING SECONDARY ALIPHATIC AMINO GROUPS AAAS, PNMT, PARG MAPT 1595/4885LMNA 1183/4885GAA 3277/4885

“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.