SCHEMBL20128479

SCHEMBL20128479

OC(c1ccccc1)(c1ccccc1)[C@@H]1CCCN1Cc1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.51
KCNH2 Q12809 1/20 0.48
HRH1 P35367 1/20 0.47
ATM Q13315 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
GBA1 P04062 1/20 0.44
SPHK2 Q9NRA0 2/20 0.44
SPHK1 Q9NYA1 2/20 0.44
ALDH1A1 P00352 1/20 0.44

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
SCHEMBL9015295 1.00 LMNA (0.51) LMNAKCNH2HRH1ATML3MBTL1
SCHEMBL20128497 0.90 SPHK2 (0.44) LMNAL3MBTL1SPHK2SPHK1
SCHEMBL20128495 0.86 HRH1 (0.44) LMNAHRH1GBA1SPHK2SPHK1
SCHEMBL20128478 0.83 CYP2D6 (0.45) GBA1SPHK2SPHK1ALDH1A1
SCHEMBL6304543 0.83 GBA1 (0.46) GBA1SPHK2SPHK1ALDH1A1
SCHEMBL8336619 0.83 LMNA (0.56) LMNAHRH1ATML3MBTL1
SCHEMBL8339280 0.83 LMNA (0.56) LMNAHRH1ATML3MBTL1
SCHEMBL1303955 0.83 GBA1 (0.46) GBA1SPHK2SPHK1ALDH1A1
SCHEMBL1303954 0.83 GBA1 (0.46) GBA1SPHK2SPHK1ALDH1A1
SCHEMBL8336623 0.83 LMNA (0.56) LMNAHRH1ATML3MBTL1

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-10040760-B2 Pyrrolidine compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2018-08-07 US disclosed
US-20180127364-A1 PYRROLIDINE COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2018-05-10 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 (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-20180127364-A1 PYRROLIDINE COMPOUND CAT, POLI, PPOX LMNA 4051/4885KCNH2 1432/4885HRH1 1127/4885
US-10040760-B2 Pyrrolidine compound CAT, POLI, PPOX LMNA 4051/4885KCNH2 1432/4885HRH1 1127/4885

“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.