SCHEMBL20128495

SCHEMBL20128495

Cc1cc(C)cc(C(O)(c2cc(C)cc(C)c2)[C@@H]2CCCN2Cc2ccccc2)c1

nearest known ligand 0.44

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 1/20 0.44
LMNA P02545 1/20 0.42
SPHK1 Q9NYA1 6/20 0.42
SPHK2 Q9NRA0 5/20 0.42
TACR1 P25103 1/20 0.39
GBA1 P04062 1/20 0.39
ALDH1A1 P00352 1/20 0.39
MAPT P10636 1/20 0.39

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 0.86 LMNA (0.51) HRH1LMNASPHK1SPHK2GBA1
SCHEMBL20128479 0.86 LMNA (0.51) HRH1LMNASPHK1SPHK2GBA1
SCHEMBL20128486 0.86 TACR1 (0.42) SPHK1SPHK2TACR1ALDH1A1MAPT
SCHEMBL20128497 0.81 SPHK2 (0.44) LMNASPHK1SPHK2
SCHEMBL17268180 0.80 LMNA (0.46) HRH1LMNAALDH1A1MAPT
SCHEMBL20383527 0.80 LMNA (0.46) HRH1LMNAALDH1A1MAPT
SCHEMBL1303955 0.79 GBA1 (0.46) SPHK1SPHK2GBA1ALDH1A1
SCHEMBL1303954 0.79 GBA1 (0.46) SPHK1SPHK2GBA1ALDH1A1
SCHEMBL6304543 0.79 GBA1 (0.46) SPHK1SPHK2GBA1ALDH1A1
SCHEMBL20128487 0.78 SPHK1 (0.40) SPHK1SPHK2TACR1MAPT

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 HRH1 1127/4885LMNA 4051/4885SPHK1 746/4885
US-10040760-B2 Pyrrolidine compound CAT, POLI, PPOX HRH1 1127/4885LMNA 4051/4885SPHK1 746/4885

“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.