SCHEMBL8097555

SCHEMBL8097555

CCCCOc1ccc(CN2CCC(O)CC2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 5/20 1.00
ALDH1A1 P00352 2/20 1.00
MEN1 O00255 2/20 1.00
KMT2A Q03164 2/20 1.00
CYP2D6 P10635 1/20 1.00
HRH3 Q9Y5N1 4/20 0.71
ACHE P22303 1/20 0.71
TSHR P16473 1/20 0.68
S1PR5 Q9H228 6/20 0.67
NPC1 O15118 4/20 0.64
TP53 P04637 2/20 0.62
HPGD P15428 1/20 0.62
GAA P10253 1/20 0.61
S1PR1 P21453 2/20 0.56
HTR2A P28223 1/20 0.56
MCHR1 Q99705 1/20 0.56
S1PR3 Q99500 1/20 0.55

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
SCHEMBL24008438 0.97 RAB9A (0.94) RAB9AALDH1A1MEN1KMT2ACYP2D6
SCHEMBL1046370 0.86 TSHR (0.84) RAB9AALDH1A1MEN1KMT2ACYP2D6
SCHEMBL5175612 0.83 RAB9A (0.74) RAB9AALDH1A1MEN1KMT2ACYP2D6
SCHEMBL3567760 0.83 HRH3 (1.00) RAB9AALDH1A1MEN1KMT2ACYP2D6
SCHEMBL5174712 0.82 RAB9A (0.76) RAB9AALDH1A1MEN1KMT2ACYP2D6
SCHEMBL2390775 0.81 MEN1 (0.68) RAB9AALDH1A1MEN1KMT2ACYP2D6
SCHEMBL1044760 0.81 RAB9A (0.91) RAB9AALDH1A1MEN1KMT2ACYP2D6
SCHEMBL15921120 0.81 SPHK1 (0.78) RAB9AALDH1A1MEN1KMT2ACYP2D6
SCHEMBL24008777 0.81 RAB9A (0.68) RAB9AALDH1A1MEN1KMT2ACYP2D6
SCHEMBL3041709 0.80 S1PR5 (1.00) RAB9AALDH1A1MEN1KMT2ACYP2D6

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
WO-2021224864-A1 NON-LYSOSOMAL GLUCOSYLCERAMIDASE INHIBITORS AND USES THEREOF ALECTOS THERAPEUTICS INC. (CA) 2021-11-11 WO disclosed
US-20090023773-A1 COMPOSITIONS AND METHODS FOR MODULATING GATED ION CHANNELS PAINCEPTOR PHARMA CORPORATION (CA) 2009-01-22 US disclosed
WO-2009000085-A1 QUINOLINE AND QUINAZOLINE DERIVATIVES USEFUL AS MODULATORS OF GATED ION CHANNELS PAINCEPTOR PHARMA CORPORATION (CA) 2008-12-31 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 (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-20090023773-A1 COMPOSITIONS AND METHODS FOR MODULATING GATED ION CHANNELS TRPV1, TRPV2, TRPA1 RAB9A 2269/4885ALDH1A1 2694/4885MEN1 4478/4885

“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.