SCHEMBL13248476

SCHEMBL13248476

CC(C)(C)c1ccc(N2CC(O)C2)nc1

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 2/20 0.46
GRIN2B Q13224 1/20 0.42
HCRTR1 O43613 4/20 0.40
HCRTR2 O43614 4/20 0.40
KDM4E B2RXH2 4/20 0.40
ABL1 P00519 1/20 0.40
LMNA P02545 1/20 0.40
ACACB O00763 2/20 0.39
HRH3 Q9Y5N1 1/20 0.39
MAPT P10636 4/20 0.39
ALDH1A1 P00352 1/20 0.39
HSD11B1 P28845 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.38
PANK3 Q9H999 2/20 0.38
HPGD P15428 1/20 0.37
POLB P06746 1/20 0.37
MAPK1 P28482 1/20 0.37

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
SCHEMBL13248481 0.88 TRPV1 (0.59) TRPV1KDM4EABL1LMNAHRH3
SCHEMBL14349616 0.88 TRPV1 (0.59) TRPV1KDM4EABL1LMNAHRH3
SCHEMBL26796035 0.85 CNR2 (0.42) TRPV1GRIN2BHCRTR1HCRTR2KDM4E
SCHEMBL10331337 0.84 KDM4E (0.50) TRPV1KDM4EABL1LMNAHRH3
SCHEMBL19959074 0.83 HCRTR1 (0.40) TRPV1GRIN2BHCRTR1HCRTR2KDM4E
SCHEMBL26151690 0.83 HCRTR1 (0.43) TRPV1GRIN2BHCRTR1HCRTR2KDM4E
SCHEMBL21081457 0.82 HDAC1 (0.45) TRPV1GRIN2BHCRTR1HCRTR2KDM4E
SCHEMBL19001116 0.82 CNR2 (0.49) TRPV1GRIN2BHCRTR1HCRTR2KDM4E
SCHEMBL19001030 0.82 CNR2 (0.49) TRPV1GRIN2BHCRTR1HCRTR2KDM4E
SCHEMBL14349536 0.81 KMT2A (0.49) GRIN2BHCRTR1HCRTR2KDM4EMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230382909-A1 BICYCLIC COMPOUNDS ALIGOS THERAPEUTICS, INC. 2023-11-30 US disclosed
US-20230374008-A1 BICYCLIC COMPOUNDS ALIGOS THERAPEUTICS, INC. 2023-11-23 US disclosed
US-20100190761-A1 DIPHENYL SUBSTITUTED ALKANES MERCK SHARP & DOHME CORP. 2010-07-29 US disclosed
US-7312209-B2 Acridone inhibitors of IMPDH enzyme BRISTOL-MYERS SQUIBB COMPANY (US) 2007-12-25 US disclosed
US-7312209-B2 Acridone inhibitors of IMPDH enzyme BRISTOL-MYERS SQUIBB COMPANY (US) 2007-12-25 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 (3 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-20230382909-A1 BICYCLIC COMPOUNDS SLC10A1, PKD1, CYP11B2 TRPV1 796/4885GRIN2B 3002/4885HCRTR1 1808/4885
US-20230374008-A1 BICYCLIC COMPOUNDS SLC10A1, PKD1, CYP11B2 TRPV1 796/4885GRIN2B 3002/4885HCRTR1 1808/4885
US-20100190761-A1 DIPHENYL SUBSTITUTED ALKANES ALOX5, ALOX15, ALOX15B TRPV1 448/4885GRIN2B 3446/4885HCRTR1 2744/4885

“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.