SCHEMBL30736650

SCHEMBL30736650

C=CCOC(=O)N1CCC2(CCNCC2)CC1

nearest known ligand 0.58

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.43
GABRD O14764 2/20 0.40
GABRA1 P14867 2/20 0.40
GABRB1 P18505 2/20 0.40
GABRA5 P31644 2/20 0.40
GABRA3 P34903 2/20 0.40
GABRA2 P47869 2/20 0.40
GABRB2 P47870 2/20 0.40
GABRA4 P48169 2/20 0.40
CYP2D6 P10635 2/20 0.40
LMNA P02545 1/20 0.38
MAPK1 P28482 1/20 0.38
RAB9A P51151 1/20 0.38

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 SCHEMBL30984509 0.98 CYP1A2 (0.42) CYP1A2GABRDGABRA1GABRB1GABRA5
SCHEMBL1780077 0.84 LMNA (0.43) LMNAMAPK1RAB9A
Hydrochloric Acid SCHEMBL20488405 0.82 LMNA (0.42) LMNAMAPK1RAB9A
SCHEMBL30736784 0.79 GPR119 (0.44) CYP2D6LMNAMAPK1RAB9A
SCHEMBL27282761 0.79 CYP1A2 (0.44) CYP1A2CYP2D6LMNAMAPK1RAB9A
SCHEMBL30592964 0.78 CA2 (0.42) LMNAMAPK1RAB9A
Trifluoroacetic Acid SCHEMBL18497410 0.78 LMNA (0.45) LMNAMAPK1RAB9A
SCHEMBL20101964 0.78 LMNA (0.44) CYP1A2CYP2D6LMNAMAPK1RAB9A
Morpholine SCHEMBL8023056 0.76 TSHR (0.50) LMNAMAPK1RAB9A
SCHEMBL21409258 0.75 LMNA (0.54) CYP1A2GABRDGABRA1GABRB1GABRA5

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
EP-4561575-A2 CDK2 INHIBITORS AND METHODS OF USING THE SAME Cedilla Therapeutics, Inc. (US) 2025-06-04 EP disclosed