SCHEMBL22264759

SCHEMBL22264759

O=C(O)/C=C/c1cc(Br)ccc1OCCN1CCCC1

nearest known ligand 0.63

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.63
KMT2A Q03164 3/20 0.63
HTR1B P28222 1/20 0.54
ALDH1A1 P00352 3/20 0.54
ACHE P22303 4/20 0.53
KDM4E B2RXH2 5/20 0.52
POLB P06746 2/20 0.52
GAA P10253 1/20 0.52
TDP1 Q9NUW8 1/20 0.52
MAPT P10636 1/20 0.51
HTT P42858 1/20 0.51
HRH1 P35367 1/20 0.49
NPC1 O15118 1/20 0.46
RAB9A P51151 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
BCHE P06276 2/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
HRH3 Q9Y5N1 1/20 0.45

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
SCHEMBL30685360 0.85 MEN1 (0.60) MEN1KMT2AHTR1BALDH1A1ACHE
SCHEMBL26363789 0.85 MEN1 (0.60) MEN1KMT2AHTR1BALDH1A1ACHE
SCHEMBL22264915 0.82 MEN1 (0.69) MEN1KMT2AHTR1BALDH1A1KDM4E
SCHEMBL31320844 0.82 MEN1 (0.61) MEN1KMT2AHTR1BALDH1A1KDM4E
SCHEMBL4472138 0.82 MEN1 (0.61) MEN1KMT2AHTR1BALDH1A1KDM4E
SCHEMBL4471981 0.79 MEN1 (0.57) MEN1KMT2AHTR1BALDH1A1KDM4E
SCHEMBL22265010 0.78 ACHE (0.48) MEN1KMT2AALDH1A1ACHEKDM4E
SCHEMBL12469444 0.78 HPGD (0.51) MEN1KMT2AALDH1A1KDM4EPOLB
SCHEMBL2215886 0.78 TSHR (0.58) MEN1KMT2AALDH1A1KDM4EPOLB
SCHEMBL2215883 0.78 TSHR (0.58) MEN1KMT2AALDH1A1KDM4EPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3914256-B1 GPR35 MODULATORS PROMETHEUS BIOSCIENCES INC (US) 2024-05-29 EP disclosed
US-11773101-B2 GPR35 modulators PROMETHEUS BIOSCIENCES, INC. (US) 2023-10-03 US disclosed
US-20210380590-A1 GPR35 MODULATORS PROMETHEUS BIOSCIENCES, INC. 2021-12-09 US disclosed
EP-3914256-A1 GPR35 MODULATORS Prometheus Biosciences, Inc. (US) 2021-12-01 EP disclosed
CN-113631168-A GPR35 modulators 普罗米修斯生物科学公司 2021-11-09 CN disclosed
US-11053251-B2 GPR35 modulators PROMETHEUS BIOSCIENCES, INC. (US) 2021-07-06 US disclosed
WO-2020154492-A1 GPR35 MODULATORS PROMETHEUS BIOSCIENCES, INC. (US) 2020-07-30 WO disclosed
US-20200239476-A1 GPR35 MODULATORS PROMETHEUS BIOSCIENCES, INC. 2020-07-30 US 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 (4 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-20210380590-A1 GPR35 MODULATORS GPR35, GPR55, GPR65 MEN1 3744/4885KMT2A 4331/4885HTR1B 299/4885
US-11053251-B2 GPR35 modulators GPR35, GPR55, GPR65 MEN1 3744/4885KMT2A 4331/4885HTR1B 299/4885
US-11773101-B2 GPR35 modulators GPR35, GPR55, GPR65 MEN1 3744/4885KMT2A 4331/4885HTR1B 299/4885
US-20200239476-A1 GPR35 MODULATORS GPR35, GPR55, GPR65 MEN1 3744/4885KMT2A 4331/4885HTR1B 299/4885

“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.