SCHEMBL29891706

SCHEMBL29891706

NC1CCN(C(=O)C(F)(F)F)[C@H](c2ccccc2)C1

nearest known ligand 0.54

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
RIPK1 Q13546 14/20 0.54
KDM1A O60341 1/20 0.44
TACR1 P25103 1/20 0.44
ESR1 P03372 1/20 0.43
ESR2 Q92731 1/20 0.43
CHRM2 P08172 1/20 0.39
CHRM1 P11229 1/20 0.39
CHRM3 P20309 1/20 0.39
SMYD3 Q9H7B4 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
SCHEMBL16401264 0.84 RIPK1 (0.49) RIPK1KDM1ATACR1SMYD3
SCHEMBL27077252 0.81 RIPK1 (0.51) RIPK1KDM1ATACR1ESR1ESR2
SCHEMBL29116152 0.81 RIPK1 (0.48) RIPK1KDM1AESR1ESR2CHRM3
SCHEMBL27077325 0.80 KDM1A (0.56) RIPK1KDM1ATACR1ESR1ESR2
SCHEMBL1576663 0.80 RIPK1 (0.73) RIPK1ESR1ESR2
SCHEMBL28171621 0.78 RIPK1 (0.67) RIPK1ESR1ESR2
SCHEMBL17964187 0.78 RIPK1 (0.51) RIPK1KDM1AESR1ESR2
SCHEMBL17782223 0.77 RIPK1 (0.50) RIPK1KDM1A
SCHEMBL29893426 0.77 RIPK1 (0.53) RIPK1KDM1ATACR1ESR1ESR2
SCHEMBL29891698 0.77 RIPK1 (0.46) RIPK1KDM1A

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-4313295-A1 PHARMACEUTICAL COMPOUNDS AS INHIBITORS OF UBIQUITIN SPECIFIC PROTEASE 19 (USP19) Almac Discovery Limited (GB) 2024-02-07 EP disclosed
WO-2022200523-A9 PHARMACEUTICAL COMPOUNDS AS INHIBITORS OF UBIQUITIN SPECIFIC PROTEASE 19 (USP19) ALMAC DISCOVERY LIMITED (GB) 2023-02-16 WO disclosed
WO-2022200523-A1 PHARMACEUTICALS COMPOUNDS AS INHIBITORS OF UBIQUITIN SPECIFIC PROTEASE 19 (USP19) ALMAC DISCOVERY LIMITED (GB) 2022-09-29 WO disclosed