SCHEMBL4841395

SCHEMBL4841395

COC(=O)c1cc(C)c(OCCN)c(C)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PLAU P00749 8/20 0.54
▸ LMNA P02545 3/20 0.46
▸ GAA P10253 2/20 0.46
▸ KDM4E B2RXH2 2/20 0.46
▸ POLB P06746 1/20 0.46
▸ NFKB1 P19838 1/20 0.46
▸ XDH P47989 1/20 0.46
▸ GFER P55789 1/20 0.46
▸ NFKB2 Q00653 1/20 0.46
▸ RELA Q04206 1/20 0.46
▸ FUT7 Q11130 1/20 0.46
▸ TDP1 Q9NUW8 1/20 0.46
▸ L3MBTL1 Q9Y468 1/20 0.46
▸ PPARA Q07869 2/20 0.44
▸ CA12 O43570 1/20 0.43
▸ CA1 P00915 1/20 0.43
▸ CA2 P00918 1/20 0.43
▸ CA7 P43166 1/20 0.43
▸ CA9 Q16790 1/20 0.43
▸ CA14 Q9ULX7 1/20 0.43

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
Hydrochloric Acid SCHEMBL4841382 0.98 PLAU (0.53) PLAULMNAGAAKDM4EPOLB
SCHEMBL14999535 0.83 ESR1 (0.55) LMNAGAAKDM4ETDP1L3MBTL1
SCHEMBL8235966 0.80 PLAU (0.59) PLAULMNAGAAKDM4EPOLB
SCHEMBL4842935 0.80 TDP1 (0.52) PLAULMNAGAAKDM4EXDH
SCHEMBL20758466 0.79 MAPT (0.53) LMNAGAAKDM4EPOLBNFKB1
Hydrochloric Acid SCHEMBL4842924 0.78 TDP1 (0.51) PLAULMNAGAAKDM4EXDH
SCHEMBL17991550 0.76 NOTUM (0.59) LMNAGAAKDM4EXDHTDP1
SCHEMBL1739400 0.76 CA1 (0.54) LMNAGAAKDM4EPOLBNFKB1
SCHEMBL2716177 0.75 PPARA (0.47) LMNAGAAKDM4EPOLBNFKB1
SCHEMBL26926134 0.75 LMNA (0.44) LMNAGAAKDM4EPOLBNFKB1

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-7465811-B2 Indoline compounds LABORATOIRES FOURNIER S.A. (FR) 2008-12-16 — — US disclosed
US-20080119465-A1 Novel Indoline Compounds LABORATORIES FOURNIER S.A. (FR) 2008-05-22 — — US 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-20080119465-A1 Novel Indoline Compounds GPR119, INSR, IRS1 PLAU 4576/4885LMNA 1943/4885GAA 1612/4885

“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.

Send feedback