Bromide

Bromide

SCHEMBL14917356

Br.O=Cc1cc2c(cc1O)CCNC2

nearest known ligand 0.65

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ACHEADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ADRB3APH1AAPH1BCHRM2CHRM3EZH2GRIN2AHTR1AHTR1BHTR1DHTR1FHTR3ANCSTNP2RY12PSEN1PSEN2PSENENSIGMAR1SLC6A2SLC6A3SLC6A4

The experimentally established mechanism targets of Bromide. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ ADRA2A known ✓ P08913 2/20 0.41
▸ ADRA2B known ✓ P18089 2/20 0.41
▸ ADRA2C known ✓ P18825 2/20 0.41
▸ ADCY6 O43306 1/20 0.50
▸ ADCY3 O60266 1/20 0.50
▸ ADCY9 O60503 1/20 0.50
▸ ADCY5 O95622 1/20 0.50
▸ ADCY8 P40145 1/20 0.50
▸ ADCY7 P51828 1/20 0.50
▸ ADCY2 Q08462 1/20 0.50
▸ ADCY1 Q08828 1/20 0.50
▸ ADCY4 Q8NFM4 1/20 0.50
▸ PNMT P11086 4/20 0.41
▸ ASIC3 Q9UHC3 1/20 0.39

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
Bromide SCHEMBL30406608 1.00 ADCY6 (0.50) ADCY6ADCY3ADCY9ADCY5ADCY8
Bromide SCHEMBL14917391 1.00 ADCY6 (0.50) ADCY6ADCY3ADCY9ADCY5ADCY8
SCHEMBL14925144 0.98 ADCY6 (0.52) ADCY6ADCY3ADCY9ADCY5ADCY8
SCHEMBL14925149 0.98 ADCY6 (0.52) ADCY6ADCY3ADCY9ADCY5ADCY8
Bromide SCHEMBL3503361 0.82 ADCY6 (0.74) ADCY6ADCY3ADCY9ADCY5ADCY8
SCHEMBL232676 0.80 ADCY6 (0.77) ADCY6ADCY3ADCY9ADCY5ADCY8
SCHEMBL30578821 0.80 ADCY6 (0.77) ADCY6ADCY3ADCY9ADCY5ADCY8
SCHEMBL30578817 0.80 ADCY6 (0.77) ADCY6ADCY3ADCY9ADCY5ADCY8
Hydrochloric Acid SCHEMBL3322965 0.78 ADCY6 (0.74) ADCY6ADCY3ADCY9ADCY5ADCY8
SCHEMBL19599676 0.78 PNMT (0.37) PNMTADRA2AADRA2BADRA2CASIC3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110172051-B IRE-1 alpha inhibitors 复星弘创(苏州)医药科技有限公司 2023-03-07 — — CN disclosed
US-11337956-B2 IRE-1α inhibitors FOSUN ORINOVE PHARMATECH, INC. (CN) 2022-05-24 — — US disclosed
EP-3799870-A1 IRE-1A INHIBITORS Fosun Orinove Pharmatech, Inc. (CN) 2021-04-07 — — EP disclosed
EP-3409276-B1 IRE-1A INHIBITORS FOSUN ORINOVE PHARMATECH INC (CN) 2020-12-30 — — EP disclosed
US-20190314330-A1 IRE-1ALPHA INHIBITORS FOSUN ORINOVE PHARMATECH, INC. (CN) 2019-10-17 — — US disclosed
US-10357475-B2 IRE-1α inhibitors FOSUN ORINOVE PHARMATECH, INC. (CN) 2019-07-23 — — US disclosed
EP-3409276-A1 IRE-1A INHIBITORS Fosun Orinove Pharmatech, Inc. (CN) 2018-12-05 — — EP disclosed
EP-2555768-B1 IRE-1 INHIBITORS FOSUN ORINOVE PHARMATECH INC (CN) 2018-08-29 — — EP disclosed
US-9867803-B2 IRE-1α inhibitors SHANGHAI FOSUN PHARMACEUTICAL INDUSTRIAL DEVELOPMENT CO. LTD. (CN) 2018-01-16 — — US disclosed
US-20170326104-A1 IRE-1ALPHA INHIBITORS FOSUN ORINOVE PHARMATECH, INC. (CN) 2017-11-16 — — US disclosed
US-9693992-B2 IRE-1α inhibitors MANNKIND CORPORATION (US) 2017-07-04 — — US disclosed
US-9040714-B2 IRE-1α inhibitors MANNKIND CORPORATION (US) 2015-05-26 — — US disclosed
US-20150141424-A1 IRE-1alpha INHIBITORS FOSUN ORINOVE PHARMATECH, INC. (CN) 2015-05-21 — — US disclosed
US-20130116247-A1 IRE-1alpha INHIBITORS MANNKIND CORPORATION (US) 2013-05-09 — — 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 (6 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-20150141424-A1 IRE-1alpha INHIBITORS ERN1, XBP1, ERN2 ADRA2A 3790/4885ADRA2B 3840/4885ADRA2C 3991/4885
US-20170326104-A1 IRE-1ALPHA INHIBITORS ERN1, XBP1, ERN2 ADRA2A 3790/4885ADRA2B 3840/4885ADRA2C 3991/4885
US-11337956-B2 IRE-1α inhibitors XBP1, ERN1, ERN2 ADRA2A 3863/4885ADRA2B 3942/4885ADRA2C 4163/4885
US-20190314330-A1 IRE-1ALPHA INHIBITORS ERN1, XBP1, ERN2 ADRA2A 3790/4885ADRA2B 3840/4885ADRA2C 3991/4885
US-10357475-B2 IRE-1α inhibitors XBP1, ERN1, ERN2 ADRA2A 3863/4885ADRA2B 3942/4885ADRA2C 4163/4885
US-20130116247-A1 IRE-1alpha INHIBITORS ERN1, XBP1, ERN2 ADRA2A 3775/4885ADRA2B 3870/4885ADRA2C 3994/4885

“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.

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