Bromide

Bromide

SCHEMBL3923746

Br.N=c1scnn1Cc1ccccc1

nearest known ligand 0.44

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 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.44
RECQL P46063 1/20 0.42
SMN1; SMN2 Q16637 2/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
CYP19A1 P11511 3/20 0.41
ALDH1A1 P00352 5/20 0.41
KDM4E B2RXH2 3/20 0.41
HPGD P15428 1/20 0.40
ALOX15 P16050 1/20 0.40
HSD17B10 Q99714 1/20 0.40
LMNA P02545 2/20 0.39
KMT2A Q03164 1/20 0.39
SLC9A1 P19634 1/20 0.39
GRM2 Q14416 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.37
IDO1 P14902 1/20 0.37
GAA P10253 1/20 0.37
CASP3 P42574 1/20 0.37
NR1H3 Q13133 1/20 0.37

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
SCHEMBL9724931 0.98 TSHR (0.45) TSHRRECQLSMN1; SMN2NPC1RAB9A
SCHEMBL6360177 0.80 ALDH1A1 (0.53) RECQLALDH1A1ALOX15HSD17B10LMNA
SCHEMBL10357861 0.69 TSHR (0.39) TSHRRECQLSMN1; SMN2NPC1RAB9A
SCHEMBL9724804 0.69 TSHR (0.39) TSHRRECQLSMN1; SMN2NPC1RAB9A
SCHEMBL4361625 0.66 P2RX7 (0.56) TSHRRECQLSMN1; SMN2NPC1RAB9A
SCHEMBL23749756 0.64 SMN1; SMN2 (0.47) TSHRSMN1; SMN2NPC1RAB9ACYP19A1
SCHEMBL4365345 0.64 TSHR (0.56) TSHRRECQLCYP19A1ALDH1A1KDM4E
SCHEMBL144813 0.63 TSHR (0.69) TSHRRECQLSMN1; SMN2CYP19A1ALDH1A1
SCHEMBL23749741 0.63 CHRNB2 (0.59) SMN1; SMN2NPC1RAB9AALDH1A1KDM4E
SCHEMBL7174067 0.62 RECQL (0.56) TSHRRECQLCYP19A1ALDH1A1KDM4E

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
US-7560456-B2 Pesticidal pyridinecarboxamide derivatives MERIAL LIMITED (US) 2009-07-14 US disclosed
EP-1507762-B1 PESTICIDAL PYRIDINECARBOXAMIDE DERIVATIVES BAYER CROPSCIENCE GMBH (DE) 2006-08-02 EP disclosed
US-20050227970-A1 Pesticidal pyridinecarboxamide derivatives MERIAL LIMITED 2005-10-13 US disclosed
EP-1507762-A1 PESTICIDAL PYRIDINECARBOXAMIDE DERIVATIVES Bayer CropScience GmbH (DE) 2005-02-23 EP disclosed
WO-2003097605-A1 PESTICIDAL PYRIDINECARBOXAMIDE DERIVATIVES BAYER CROPSCIENCE GMBH (DE) 2003-11-27 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 (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-20050227970-A1 Pesticidal pyridinecarboxamide derivatives DDT, ACHE, PTMS TSHR 1529/4885RECQL 1556/4885SMN1; SMN2 3046/4885

“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.