SCHEMBL17485296

SCHEMBL17485296

CCN1CCC2(CC1)CC(=O)N(C)C2

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 4/20 0.49
CYP11B2 P19099 4/20 0.49
TSHR P16473 1/20 0.38
CRBN Q96SW2 1/20 0.38
CHRM2 P08172 1/20 0.37
CHRM3 P20309 1/20 0.37
SIGMAR1 Q99720 4/20 0.34
OPRM1 P35372 5/20 0.32
OPRD1 P41143 2/20 0.32
OPRK1 P41145 2/20 0.32
LRRK2 Q5S007 1/20 0.32
KCNH2 Q12809 2/20 0.31
ADRA1B P35368 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
SCHEMBL18820444 0.88 TSHR (0.44) CYP11B1CYP11B2TSHRCRBNCHRM2
SCHEMBL26790423 0.87 CYP11B1 (0.38) CYP11B1CYP11B2TSHRCRBNCHRM2
SCHEMBL26850392 0.84 TSHR (0.39) CYP11B1CYP11B2TSHRCHRM2CHRM3
SCHEMBL24235261 0.83 CYP11B1 (0.39) CYP11B1CYP11B2CRBNCHRM2CHRM3
SCHEMBL3477441 0.82 CYP11B1 (0.40) CYP11B1CYP11B2TSHRCRBNCHRM2
SCHEMBL1753879 0.81 CYP11B1 (0.50) CYP11B1CYP11B2TSHRCRBNCHRM2
SCHEMBL16189944 0.80
SCHEMBL24994297 0.77 CYP2D6 (0.55) CYP11B1CYP11B2TSHRCHRM2CHRM3
SCHEMBL12832226 0.76 CYP11B1 (0.46) CYP11B1CYP11B2TSHRCRBNCHRM2
SCHEMBL24186788 0.75 CYP11B1 (0.46) CYP11B1CYP11B2CRBNLRRK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230041621-A1 SSTR5 ANTAGONISTS KALLYOPE, INC. 2023-02-09 US disclosed
US-20200163336-A1 CYCLIC AMINE COMPOUND AND PEST CONTROL AGENT NIPPON SODA CO., LTD. (JP) 2020-05-28 US disclosed
WO-2016015604-A1 COMPOUNDS AS CDK SMALL-MOLECULE INHIBITORS AND USES THEREOF SUNSHINE LAKE PHARMA CO., LTD. (CN) 2016-02-04 WO disclosed
WO-2016015605-A1 COMPOUNDS AS CDK SMALL-MOLECULE INHIBITORS AND USES THEREOF SUNSHINE LAKE PHARMA CO., LTD. (CN) 2016-02-04 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-20230041621-A1 SSTR5 ANTAGONISTS SSTR5, GLP1R, GPR119 CYP11B1 1217/4885CYP11B2 1009/4885TSHR 128/4885
US-20200163336-A1 CYCLIC AMINE COMPOUND AND PEST CONTROL AGENT H1-10, TAAR1, C5 CYP11B1 2392/4885CYP11B2 2532/4885TSHR 65/4885

“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.