SCHEMBL21660811

SCHEMBL21660811

O=C(O)CNC(=O)C1CCN1c1ccc(F)cc1F

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.39
EGLN2 Q96KS0 1/20 0.39
EGLN1 Q9GZT9 1/20 0.39
EGLN3 Q9H6Z9 1/20 0.39
PTGDR2 Q9Y5Y4 1/20 0.38
TP53 P04637 1/20 0.38
GAA P10253 2/20 0.38
L3MBTL1 Q9Y468 2/20 0.37
P2RX7 Q99572 1/20 0.37
NPC1 O15118 1/20 0.37
POLB P06746 1/20 0.37
RAB9A P51151 1/20 0.37
USP5 P45974 3/20 0.37
ALDH1A1 P00352 2/20 0.37
GRM5 P41594 1/20 0.36
ACKR3 P25106 1/20 0.36

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
SCHEMBL21864002 0.90 USP5 (0.39) EGLN2EGLN1EGLN3PTGDR2P2RX7
SCHEMBL21660803 0.88 KDM4E (0.44) HTTTP53L3MBTL1P2RX7RAB9A
SCHEMBL21660817 0.85 CHRM4 (0.45) EGLN2EGLN1EGLN3PTGDR2ALDH1A1
SCHEMBL21660770 0.82 EGLN1 (0.43) EGLN1TP53USP5ALDH1A1
SCHEMBL21660807 0.81 HTT (0.43) HTTTP53GAAL3MBTL1NPC1
SCHEMBL21864011 0.81 PSMB5 (0.43) TP53L3MBTL1P2RX7ACKR3
SCHEMBL21864004 0.80 ALDH1A1 (0.41) HTTTP53P2RX7RAB9AALDH1A1
SCHEMBL21864051 0.78 PSMB5 (0.57)
SCHEMBL21661134 0.78 CHRM2 (0.38) EGLN1USP5
SCHEMBL21660809 0.76 GAA (0.42) HTTTP53GAAL3MBTL1NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3831834-A1 BORATE OF AZETIDINE DERIVATIVE Chia Tai Tianqing Pharmaceutical Group Co., Ltd. (CN) 2021-06-09 EP disclosed
US-20210163507-A1 BORATE OF AZETIDINE DERIVATIVE CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD. (CN) 2021-06-03 US disclosed
US-11014943-B2 Azetidine derivative CHIA TAI TIANQING PHARMACEUTICAL GROUP GO., LTD. (CN) 2021-05-25 US disclosed
US-20200115392-A1 AZETIDINE DERIVATIVE CHIA TAI TIANQING PHARMACEUTICAL GROUP CO., LTD. (CN) 2020-04-16 US disclosed
WO-2020025037-A1 BORATE OF AZETIDINE DERIVATIVE 正大天晴药业集团股份有限公司 2020-02-06 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-11014943-B2 Azetidine derivative BCL9, MCL1, BCL9L HTT 1097/4885EGLN2 3442/4885EGLN1 4319/4885
US-20200115392-A1 AZETIDINE DERIVATIVE BCL9, MCL1, BCL9L HTT 1097/4885EGLN2 3442/4885EGLN1 4319/4885
US-20210163507-A1 BORATE OF AZETIDINE DERIVATIVE BCL9, BCL6, BCL6B HTT 640/4885EGLN2 2920/4885EGLN1 3366/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.