SCHEMBL28630053

SCHEMBL28630053

CC1CNCCC1OC(N)=O

nearest known ligand 0.36

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ATM Q13315 2/20 0.36
KDM4E B2RXH2 1/20 0.36
MAPT P10636 1/20 0.36
KMT2A Q03164 1/20 0.36
CYP2D6 P10635 1/20 0.36
SSTR1 P30872 2/20 0.33
SSTR4 P31391 2/20 0.33
SLC6A1 P30531 2/20 0.32
GABRA5 P31644 2/20 0.32
GABRB2 P47870 2/20 0.32
SLC6A12 P48065 2/20 0.32
SLC6A11 P48066 2/20 0.32
SLC6A13 Q9NSD5 2/20 0.32
GABRA1 P14867 1/20 0.32
GABRR1 P24046 1/20 0.32
GABRA4 P48169 1/20 0.32
EPHX1 P07099 1/20 0.31

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
SCHEMBL9929676 0.85 ATM (0.36) ATMKDM4EMAPTKMT2ACYP2D6
SCHEMBL28574783 0.85 ATM (0.36) ATMKDM4EMAPTKMT2ACYP2D6
SCHEMBL28574784 0.85 ATM (0.36) ATMKDM4EMAPTKMT2ACYP2D6
SCHEMBL28930445 0.85 ATM (0.36) ATMKDM4EMAPTKMT2ACYP2D6
SCHEMBL7225571 0.83 CHRM2 (0.39) KMT2ACYP2D6SSTR1SSTR4SLC6A1
SCHEMBL7225569 0.83 CHRM2 (0.39) KMT2ACYP2D6SSTR1SSTR4SLC6A1
SCHEMBL7234198 0.83 CHRM2 (0.39) KMT2ACYP2D6SSTR1SSTR4SLC6A1
SCHEMBL7226282 0.83 CHRM2 (0.39) KMT2ACYP2D6SSTR1SSTR4SLC6A1
SCHEMBL7234667 0.83 CHRM2 (0.39) KMT2ACYP2D6SSTR1SSTR4SLC6A1
SCHEMBL6500331 0.82 KDM4E (0.39) ATMKDM4EMAPTKMT2ACYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113924292-A Antimicrobial compounds and methods 库扎环球有限责任公司 2022-01-11 CN disclosed
CN-109563071-B Chemical compounds as inhibitors of the ATF4pathway 葛兰素史密斯克莱知识产权发展有限公司 2021-08-03 CN disclosed