SCHEMBL19066161

SCHEMBL19066161

O=C(ON1CCNCC1)N1CCCCC1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 2/20 0.55
CHKA P35790 1/20 0.55
ALDH1A1 P00352 3/20 0.41
POLB P06746 1/20 0.41
CA12 O43570 1/20 0.38
CA1 P00915 1/20 0.38
CA9 Q16790 1/20 0.38
HSD11B1 P28845 1/20 0.37
KDM4E B2RXH2 1/20 0.36
CHRNB2 P17787 1/20 0.35
CHRNA3 P32297 1/20 0.35
CHRNA4 P43681 1/20 0.35
CHRNB3 Q05901 1/20 0.35
CHRNA6 Q15825 1/20 0.35
SMN1; SMN2 Q16637 3/20 0.35
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
MAPT P10636 2/20 0.35
HTT P42858 2/20 0.35
LMNA P02545 1/20 0.34

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
SCHEMBL28094583 0.90 CA2 (0.46) CA2CHKAPOLBCA12CA1
SCHEMBL5320124 0.85 ALDH1A1 (0.48) CA2CHKAALDH1A1POLBHSD11B1
SCHEMBL28214835 0.82 CA2 (0.36) CA2CHKAPOLBCA12CA1
SCHEMBL29437665 0.79 CA2 (0.65) CA2CHKAALDH1A1POLBCA12
SCHEMBL5875153 0.73 CA2 (0.41) CA2CHKACA12CA1CA9
SCHEMBL5874622 0.73 CA2 (0.41) CA2CHKACA12CA1CA9
SCHEMBL25218195 0.72 CA2 (0.42) CA2CHKAALDH1A1POLBHSD11B1
SCHEMBL23152129 0.72 CA2 (0.50) CA2CHKAALDH1A1POLBCA12
SCHEMBL3175235 0.72 CA2 (1.00) CA2CHKAALDH1A1CA12CA1
SCHEMBL4958163 0.72 CA2 (0.39) CA2CHKAALDH1A1POLBCA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024099395-A1 COMPOUNDS FOR THE DEGRADATION OF EGFR KINASE BEIGENE, LTD. (KY) 2024-05-16 WO disclosed
EP-4225749-A1 COMPOUNDS AND METHODS OF TREATING CANCERS Cullgen (Shanghai), Inc. (CN) 2023-08-16 EP disclosed
WO-2022100710-A1 TYROSINE KINASE 2 (TYK2) DEGRADATION COMPOUNDS AND METHODS OF USE CULLGEN (SHANGHAI) , INC. (CN) 2022-05-19 WO disclosed
WO-2022073469-A1 COMPOUNDS AND METHODS OF TREATING CANCERS CULLGEN (SHANGHAI) , INC. (CN) 2022-04-14 WO disclosed
WO-2022012622-A1 DEGRADATION OF (EGFR) BY CONJUGATION OF EGFR INHIBITORS WITH E3 LIGASE LIGAND AND METHODS OF USE BEIGENE, LTD. (KY) 2022-01-20 WO disclosed
WO-2017114351-A1 CERTAIN PROTEIN KINASE INHIBITORS Chongqing Fochon Pharmaceutical Co., Ltd. (CN) 2017-07-06 WO disclosed