SCHEMBL26700772

SCHEMBL26700772

CC1(N)CN(C(=O)C2CC2)C1

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 8/20 0.46
HPGD P15428 1/20 0.45
CHRNB2 P17787 6/20 0.42
CHRNA3 P32297 6/20 0.42
CHRNA4 P43681 6/20 0.42
CHRNB3 Q05901 4/20 0.42
CHRNA6 Q15825 4/20 0.42
HTT P42858 1/20 0.40
ALDH1A1 P00352 1/20 0.40
TSHR P16473 1/20 0.40
CHRNB4 P30926 2/20 0.39
CHRNA7 P36544 2/20 0.39
MAPT P10636 1/20 0.39
GRM5 P41594 1/20 0.38
LMNA P02545 1/20 0.35
HSD11B2 P80365 1/20 0.34

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
Hydrochloric Acid SCHEMBL25389619 0.98 HSD11B1 (0.44) HSD11B1HPGDCHRNB2CHRNA3CHRNA4
SCHEMBL21324795 0.82 HSD11B1 (0.53) HSD11B1HPGDCHRNB2CHRNA3CHRNA4
SCHEMBL15200519 0.80 HSD11B1 (0.47) HSD11B1HPGDCHRNB2CHRNA3CHRNA4
Hydrochloric Acid SCHEMBL29809245 0.78 HPGD (0.50) HSD11B1HPGDCHRNB2CHRNA3CHRNA4
SCHEMBL22855889 0.75 HTT (0.46) HSD11B1HPGDCHRNB2CHRNA3CHRNA4
SCHEMBL24276456 0.75 CHRNB2 (0.48) HSD11B1HPGDCHRNB2CHRNA3CHRNA4
SCHEMBL25810400 0.74 HSD11B1 (0.66) HSD11B1HPGDCHRNB2CHRNA3CHRNA4
SCHEMBL25824960 0.74 HSD11B1 (0.42) HSD11B1HPGDCHRNB2CHRNA3CHRNA4
SCHEMBL17177244 0.72 GRM5 (0.49) HSD11B1HPGDCHRNB2CHRNA3CHRNA4
SCHEMBL25388586 0.72 HSD11B1 (0.41) HSD11B1HPGDCHRNB2CHRNA3CHRNA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230348424-A1 HETEROCYCLIC COMPOUNDS AND METHODS OF USE SCHRÖDINGER, INC. 2023-11-02 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-20230348424-A1 HETEROCYCLIC COMPOUNDS AND METHODS OF USE APC, RCC2, CDC37 HSD11B1 1791/4885HPGD 95/4885CHRNB2 4812/4885

“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.