SCHEMBL9115643

SCHEMBL9115643

CCC12CC3(C)CC(C)(CC(C)(C3)C1)C2

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
GRIN2D O15399 4/20 0.34
GRIN3B O60391 4/20 0.34
GRIN1 Q05586 4/20 0.34
GRIN2A Q12879 4/20 0.34
GRIN2B Q13224 4/20 0.34
GRIN2C Q14957 4/20 0.34
GRIN3A Q8TCU5 4/20 0.34
ALDH1A1 P00352 1/20 0.32
PKM P14618 1/20 0.32

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
SCHEMBL25799592 0.84 MEN1 (0.47) MEN1KMT2AGRIN2DGRIN3BGRIN1
SCHEMBL5166320 0.84 GRIN1 (0.43) MEN1KMT2AGRIN2DGRIN3BGRIN1
Hydrochloric Acid SCHEMBL7325630 0.83 GRIN1 (0.42) MEN1KMT2AGRIN2DGRIN3BGRIN1
SCHEMBL25799593 0.81 GRIN2D (0.52) MEN1KMT2AGRIN2DGRIN3BGRIN1
SCHEMBL659994 0.79 GRIN1 (0.48) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL19706467 0.76
SCHEMBL1940153 0.73 MEN1 (0.63) MEN1KMT2AGRIN2DGRIN3BGRIN1
SCHEMBL11699108 0.73 GRIN2D (0.35) MEN1KMT2AGRIN2DGRIN3BGRIN1
SCHEMBL8941008 0.73 PKM (0.44) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL11405480 0.73 PKM (0.44) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10053643-B1 Fuels and lubricants from bisaboline THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 2018-08-21 US claimed
US-11117847-B1 High density turbine and diesel fuels derived from adamantane THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 2021-09-14 US disclosed
US-10113130-B1 High density/high cetane renewable fuel blends THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 2018-10-30 US disclosed
US-10106475-B1 High density turbine and diesel fuels from tricyclic sesquiterpenes THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 2018-10-23 US disclosed
US-10053643-B1 Fuels and lubricants from bisaboline THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 2018-08-21 US disclosed
US-9777234-B1 High density turbine and diesel fuels from tricyclic sesquiterpenes THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE NAVY (US) 2017-10-03 US disclosed
WO-1995011472-A1 FIBER OPTIC CABLE AND VISCOUS FILLER MATERIAL MOBIL OIL CORPORATION (US) 1995-04-27 WO disclosed
WO-1995001319-A1 OXIDATIVE COUPLING OF DIAMONDOIDS AND AROMATICS MOBIL OIL CORPORATION (US) 1995-01-12 WO 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-10053643-B1 Fuels and lubricants from bisaboline CCR10, NAA10, FHIT MEN1 1149/4885KMT2A 2024/4885GRIN2D 3841/4885
US-10113130-B1 High density/high cetane renewable fuel blends SUPT16H, DHCR24, BET1 MEN1 3548/4885KMT2A 1651/4885GRIN2D 2901/4885

“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.