SCHEMBL22754604

SCHEMBL22754604

NC1CCC2(CCNC2)CC1

nearest known ligand 0.50

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.34
L3MBTL3 Q96JM7 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33

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 SCHEMBL29968444 0.98 TSHR (0.37) TSHRL3MBTL3L3MBTL1
SCHEMBL21841000 0.87 KDM1A (0.35) TSHR
SCHEMBL18766281 0.86 CYP2D6 (0.35) TSHR
SCHEMBL22724562 0.86 TSHR (0.32) TSHR
Hydrochloric Acid SCHEMBL29968181 0.85 KDM1A (0.34) TSHR
SCHEMBL19872316 0.81 OPRL1 (0.30)
SCHEMBL19692857 0.78 KDM1A (0.30)
SCHEMBL27480808 0.78 TSHR (0.37) TSHRL3MBTL3L3MBTL1
SCHEMBL18642963 0.78 TSHR (0.37) TSHRL3MBTL3L3MBTL1
SCHEMBL343237 0.78

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
WO-2024054512-A1 AKT1 MODULATORS ALTEROME THERAPEUTICS, INC. (US) 2024-03-14 WO disclosed
WO-2023109909-A1 AROMATIC HETEROCYCLIC COMPOUNDS, PREPARATION METHOD THEREFOR AND USES THEREOF 上海翊石医药科技有限公司 2023-06-22 WO disclosed
EP-3464272-B1 NOVEL HETEROCYCLIC DERIVATIVES USEFUL AS SHP2 INHIBITORS JACOBIO PHARMACEUTICALS CO LTD (CN) 2021-12-08 EP disclosed
EP-3312164-B1 SUBSTITUTED HETEROARYL COMPOUNDS AND METHODS OF USE CALITOR SCIENCES LLC (US) 2020-12-09 EP disclosed