SCHEMBL29979644

SCHEMBL29979644

C[C@@H](OCC1CCCCC1)[C@H](N)CO

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SLC1A3 P43003 6/20 0.46
SLC1A2 P43004 6/20 0.46
SLC1A1 P43005 6/20 0.46
CDK2 P24941 1/20 0.34
METAP2 P50579 1/20 0.33
LMNA P02545 1/20 0.32
METAP1 P53582 1/20 0.32

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
SCHEMBL29117270 1.00 SLC1A3 (0.46) SLC1A3SLC1A2SLC1A1CDK2METAP2
SCHEMBL20407296 0.81 SLC1A3 (0.47) SLC1A3SLC1A2SLC1A1METAP2
Hydrochloric Acid SCHEMBL29979565 0.79 SLC1A3 (0.41) SLC1A3SLC1A2SLC1A1
Hydrochloric Acid SCHEMBL26907832 0.79 SLC1A3 (0.41) SLC1A3SLC1A2SLC1A1
SCHEMBL10228470 0.77 SLC1A3 (0.42) SLC1A3SLC1A2SLC1A1CDK2LMNA
SCHEMBL14617215 0.77 SLC1A3 (0.42) SLC1A3SLC1A2SLC1A1CDK2LMNA
SCHEMBL17011560 0.77 SLC1A3 (0.50) SLC1A3SLC1A2SLC1A1CDK2
SCHEMBL29117192 0.76 SLC1A3 (0.38) SLC1A3SLC1A2SLC1A1
SCHEMBL29979784 0.76 SLC1A3 (0.38) SLC1A3SLC1A2SLC1A1
SCHEMBL14617224 0.74 SLC1A3 (0.40) SLC1A3SLC1A2SLC1A1LMNA

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
EP-4284365-A1 CDK2 INHIBITORS AND METHODS OF USING THE SAME Cedilla Therapeutics, Inc. (US) 2023-12-06 EP disclosed
CN-117177744-A CDK2 inhibitors and methods of use thereof 塞迪拉治疗股份有限公司 2023-12-05 CN disclosed
WO-2022165513-A1 CDK2 INHIBITORS AND METHODS OF USING THE SAME CEDILLA THERAPEUTICS, INC. (US) 2022-08-04 WO disclosed