SCHEMBL3344909

SCHEMBL3344909

O=C(O)c1coc2ccc(Br)cc2c1=O

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 10/20 0.61
MAOA P21397 2/20 0.60
PTPN1 P18031 1/20 0.56
TBK1 Q9UHD2 1/20 0.51
HTT P42858 2/20 0.50
ALDH1A1 P00352 1/20 0.50
GRIN1 Q05586 1/20 0.49
GRIN2A Q12879 1/20 0.49
GRIN2B Q13224 1/20 0.49
GRIN2C Q14957 1/20 0.49
GPR35 Q9HC97 1/20 0.49
CASP3 P42574 1/20 0.48
SENP8 Q96LD8 1/20 0.48
SENP7 Q9BQF6 1/20 0.48
SENP6 Q9GZR1 1/20 0.48
KDM4E B2RXH2 1/20 0.46
GLA P06280 1/20 0.46
MEN1 O00255 1/20 0.45
MAPT P10636 1/20 0.45
KMT2A Q03164 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
SCHEMBL6840630 0.88 CASP3 (0.55) MAOBMAOAPTPN1TBK1HTT
SCHEMBL874939 0.86 ALDH1A1 (0.56) MAOBMAOAPTPN1HTTALDH1A1
SCHEMBL3350981 0.82 MAOB (0.65) MAOBMAOAPTPN1HTTALDH1A1
SCHEMBL26054504 0.82 PTPN1 (0.51) MAOBMAOAPTPN1HTTALDH1A1
SCHEMBL11513004 0.81 MAOB (0.67) MAOBMAOAHTTALDH1A1KDM4E
SCHEMBL4576015 0.81 MAOB (0.61) MAOBMAOAPTPN1HTTALDH1A1
SCHEMBL31723115 0.81 MAOB (0.61) MAOBMAOAPTPN1HTTALDH1A1
SCHEMBL11510079 0.78 MAOB (0.67) MAOBMAOAPTPN1TBK1ALDH1A1
SCHEMBL23320560 0.78 KDM4E (0.50) MAOBMAOAHTTALDH1A1GRIN1
SCHEMBL31704456 0.78 KDM4E (0.50) MAOBMAOAHTTALDH1A1GRIN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3699174-B1 COMPOSITION FOR PREVENTING OR TREATING TNF-RELATED DISEASES, CONTAINING DERIVATIVE AS ACTIVE INGREDIENT, AND METHOD FOR INHIBITING TNF ACTIVITY BY USING SAME ILAB (KR) 2025-11-12 EP claimed
US-12329755-B2 Bromodomain inhibitors to target therapy-resistant cancer UNIVERSITY OF TENNESSEE RESEARCH FOUNDATION (US) 2025-06-17 US disclosed
CN-117024390-A Cdc20 small molecule ligand compound and application of degradation agent thereof 中国海洋大学 2023-11-10 CN disclosed
US-20220296592-A1 BROMODOMAIN INHIBITORS TO TARGET THERAPY-RESISTANT CANCER UNIVERSITY OF TENNESSEE RESEARCH FOUNDATION 2022-09-22 US disclosed
WO-2021041801-A1 BROMODOMAIN INHIBITORS TO TARGET THERAPY-RESISTANT CANCER UNIVERSITY OF TENNESSEE RESEARCH FOUNDATION (US) 2021-03-04 WO disclosed
US-20100137313-A1 HETEROCYCLIC DERIVATIVES AND METHODS OF USE THEREOF ASTRAZENECA AB 2010-06-03 US disclosed
US-20100137313-A1 HETEROCYCLIC DERIVATIVES AND METHODS OF USE THEREOF ASTRAZENECA AB 2010-06-03 US disclosed
US-20100137313-A1 HETEROCYCLIC DERIVATIVES AND METHODS OF USE THEREOF ASTRAZENECA AB 2010-06-03 US disclosed
WO-2010038081-A2 HETEROCYCLIC DERIVATIVES AND METHODS OF USE THEREOF ASTRAZENECA AB (SE) 2010-04-08 WO disclosed
WO-2010038081-A2 HETEROCYCLIC DERIVATIVES AND METHODS OF USE THEREOF ASTRAZENECA AB (SE) 2010-04-08 WO disclosed
US-4320133-A Penicillins and their antibacterial use SANDOZ LTD. (CH) 1982-03-16 US disclosed
EP-0003115-A1 Penicillins, per se and for use as antibacterially active antibiotics and their production SANDOZ AG (CH) 1979-07-25 EP 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-20100137313-A1 HETEROCYCLIC DERIVATIVES AND METHODS OF USE THEREOF SDHA, SDHB, UROD MAOB 103/4885MAOA 234/4885PTPN1 3619/4885
US-20220296592-A1 BROMODOMAIN INHIBITORS TO TARGET THERAPY-RESISTANT CANCER BRD1, SMARCE1, SMARCA1 MAOB 4607/4885MAOA 4554/4885PTPN1 4458/4885
US-12329755-B2 Bromodomain inhibitors to target therapy-resistant cancer BRD1, SMARCE1, SMARCA1 MAOB 4607/4885MAOA 4554/4885PTPN1 4458/4885

“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.