Bromide

Bromide

SCHEMBL4081272

Br.OC1(O)CCCN(Cc2ccccc2)C1

nearest known ligand 0.57

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 11)

geneUniProtsupporting neighboursconfidence
SIGMAR1 known ✓ Q99720 1/20 0.50
CYP2D6 P10635 7/20 0.57
OPRL1 P41146 1/20 0.53
POLB P06746 2/20 0.51
ALDH1A1 P00352 4/20 0.51
CYP3A4 P08684 5/20 0.50
TSHR P16473 5/20 0.50
USP2 O75604 1/20 0.49
HSD17B10 Q99714 1/20 0.49
KDM4E B2RXH2 1/20 0.48
KMT2A Q03164 1/20 0.48

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
SCHEMBL8136038 0.98 CYP2D6 (0.59) CYP2D6OPRL1POLBALDH1A1CYP3A4
SCHEMBL8199005 0.88 OPRL1 (0.62) CYP2D6OPRL1POLBALDH1A1CYP3A4
SCHEMBL28176684 0.82 CYP2D6 (0.56) CYP2D6OPRL1POLBALDH1A1CYP3A4
SCHEMBL6378751 0.82 CYP2D6 (0.57) CYP2D6OPRL1POLBALDH1A1CYP3A4
SCHEMBL5242779 0.81 OPRL1 (0.67) CYP2D6OPRL1POLBALDH1A1CYP3A4
SCHEMBL11353776 0.81 CYP2D6 (0.59) CYP2D6OPRL1ALDH1A1CYP3A4TSHR
SCHEMBL6377977 0.81 CYP2D6 (0.55) CYP2D6OPRL1POLBALDH1A1CYP3A4
SCHEMBL30889332 0.80 CYP2D6 (0.54) CYP2D6OPRL1POLBALDH1A1CYP3A4
Hydrochloric Acid SCHEMBL10750648 0.80 POLB (0.68) CYP2D6OPRL1POLBALDH1A1CYP3A4
SCHEMBL3493144 0.80 CYP2D6 (0.54) CYP2D6OPRL1POLBALDH1A1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2037919-A2 METHOD OF USING SUBSTITUTED PIPERIDINES THAT INCREASE P53 ACTIVITY SCHERING CORPORATION (US) 2009-03-25 EP disclosed
WO-2008005266-A2 METHOD OF USING SUBSTITUTED PIPERIDINES THAT INCREASE P53 ACTIVITY SCHERING CORPORATION (US) 2008-01-10 WO disclosed
US-20080004286-A1 Method of Using Substituted Piperidines that Increase P53 Activity SCHERING CORPORATION 2008-01-03 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 (1 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-20080004286-A1 Method of Using Substituted Piperidines that Increase P53 Activity TP53, MDM2, TP53BP1 SIGMAR1 4563/4885CYP2D6 3444/4885OPRL1 4256/4885

“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.