SCHEMBL1348628

SCHEMBL1348628

CC(C)=C1C[C@@H](C(=O)O)C1(C)C

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
APLNR P35414 1/20 0.33
SLC1A2 P43004 1/20 0.32
SLC1A1 P43005 1/20 0.32
HTT P42858 1/20 0.32
CD81 P60033 1/20 0.30
ESR1 P03372 1/20 0.30

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
SCHEMBL29222318 0.74 ALDH1A1 (0.39) MEN1KMT2AHTT
SCHEMBL29222333 0.74 ALDH1A1 (0.39) MEN1KMT2AHTT
SCHEMBL28535751 0.73 APLNR (0.36) MEN1KMT2AAPLNRSLC1A2SLC1A1
SCHEMBL28909985 0.73 APLNR (0.36) MEN1KMT2AAPLNRSLC1A2SLC1A1
SCHEMBL16822071 0.73 APLNR (0.36) MEN1KMT2AAPLNRSLC1A2SLC1A1
SCHEMBL21987565 0.68 L3MBTL1 (0.36) MEN1KMT2AAPLNRSLC1A2SLC1A1
SCHEMBL22151181 0.67
SCHEMBL28500595 0.67
SCHEMBL2897770 0.63
SCHEMBL22906506 0.62

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-8062651-B1 Attractant pheromone for the male pink hibiscus mealybug, Maconellicoccus hirsutus (Green) (Homoptera: Pseudococcidae) THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF AGRICULTURE (US) 2011-11-22 US claimed
US-8062651-B1 Attractant pheromone for the male pink hibiscus mealybug, Maconellicoccus hirsutus (Green) (Homoptera: Pseudococcidae) THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF AGRICULTURE (US) 2011-11-22 US disclosed