SCHEMBL3369116

SCHEMBL3369116

COC=C1C(=O)c2ccccc2C1(C)C

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PGR P06401 10/20 0.39
ALDH1A1 P00352 4/20 0.38
MAPT P10636 4/20 0.38
KDM4E B2RXH2 3/20 0.38
TDP1 Q9NUW8 3/20 0.38
CYP1A2 P05177 3/20 0.38
CYP3A4 P08684 3/20 0.38
CYP2C9 P11712 3/20 0.38
ALOX15 P16050 3/20 0.38
CDC25A P30304 2/20 0.38
CDC25B P30305 2/20 0.38
TP53 P04637 2/20 0.38
CYP2D6 P10635 2/20 0.38
CYP2C19 P33261 2/20 0.38
BLM P54132 2/20 0.38
POLB P06746 2/20 0.38
RAB9A P51151 2/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
MAP2K7 O14733 1/20 0.38
GMNN O75496 1/20 0.38

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
SCHEMBL3369111 1.00 PGR (0.39) PGRALDH1A1MAPTKDM4ETDP1
SCHEMBL3370471 0.80 PGR (0.41) PGRALDH1A1MAPTKDM4ETDP1
SCHEMBL3370477 0.80 PGR (0.41) PGRALDH1A1MAPTKDM4ETDP1
SCHEMBL11871299 0.76 HPGD (0.44) PGRALDH1A1MAPTKDM4ETDP1
SCHEMBL16746500 0.76 HPGD (0.44) PGRALDH1A1MAPTKDM4ETDP1
SCHEMBL11871293 0.76 HPGD (0.44) PGRALDH1A1MAPTKDM4ETDP1
SCHEMBL12977432 0.75 ACHE (0.50) PGRMAPTPOLBNPSR1
SCHEMBL12977427 0.75 ACHE (0.50) PGRMAPTPOLBNPSR1
SCHEMBL12997896 0.75 MEN1 (0.52) PGRALDH1A1MAPTKDM4ETDP1
SCHEMBL29522682 0.75 MEN1 (0.52) PGRALDH1A1MAPTKDM4ETDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1478616-B1 INDANES AND INDANONES AND THEIR USE IN PERFUMERY GIVAUDAN SA (CH) 2010-09-22 EP disclosed
US-7538243-B2 Indanes and indanones and their use in perfumery GIVAUDAN SA (CH) 2009-05-26 US disclosed
US-20050148493-A1 Indanes and indanones and their use in perfumery FLACHSMANN FELIX (CH) 2005-07-07 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-20050148493-A1 Indanes and indanones and their use in perfumery NISCH, CYP1B1, CYP2E1 PGR 798/4885ALDH1A1 195/4885MAPT 2815/4885

“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.