SCHEMBL434113

SCHEMBL434113

Cc1ccccc1C(CBr)=NO

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DRD4 P21917 1/20 0.42
ALDH1A1 P00352 1/20 0.38
ERCC5 P28715 1/20 0.38
FEN1 P39748 1/20 0.38
SMN1; SMN2 Q16637 3/20 0.37
KMT2A Q03164 2/20 0.37
MAOA P21397 1/20 0.37
MAOB P27338 1/20 0.37
GAA P10253 2/20 0.37
HPGD P15428 2/20 0.36
CTBP2 P56545 1/20 0.36
TSHR P16473 1/20 0.35
ACHE P22303 1/20 0.35
GSK3B P49841 1/20 0.34

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
SCHEMBL363988 0.82 ATM (0.47) DRD4ERCC5FEN1SMN1; SMN2KMT2A
SCHEMBL15239730 0.79 GSK3B (0.54) DRD4ALDH1A1ERCC5FEN1SMN1; SMN2
SCHEMBL15239732 0.79 GSK3B (0.54) DRD4ALDH1A1ERCC5FEN1SMN1; SMN2
SCHEMBL20342720 0.78 SMN1; SMN2 (0.54) DRD4ALDH1A1SMN1; SMN2KMT2ACTBP2
SCHEMBL3891431 0.74 GSK3B (0.48) DRD4ALDH1A1SMN1; SMN2KMT2AGAA
SCHEMBL22024926 0.74 GSK3B (0.48) DRD4ALDH1A1SMN1; SMN2KMT2AGAA
SCHEMBL6161952 0.74 GSK3B (0.48) DRD4ALDH1A1SMN1; SMN2KMT2AGAA
SCHEMBL6443525 0.73 MGLL (0.56) SMN1; SMN2KMT2A
SCHEMBL11172165 0.73 MAOA (0.39) DRD4ALDH1A1ERCC5FEN1SMN1; SMN2
SCHEMBL28344325 0.73 DRD4 (0.40) DRD4ERCC5FEN1SMN1; SMN2KMT2A

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
EP-2595952-B1 AGONISTS OF GPR40 CONNEXIOS LIFE SCIENCES PVT LTD (IN) 2020-11-18 EP disclosed
US-9278915-B2 Agonists of GPR40 CONNEXIOS LIFE SCIENCES PVT LTD (IN) 2016-03-08 US disclosed
US-20130237571-A1 AGONISTS OF GPR40 Conexios Life Sciences PVT. LTD. (IN) 2013-09-12 US disclosed
EP-2595952-A1 AGONISTS OF GPR40 Connexios Life Sciences Pvt. Ltd. (IN) 2013-05-29 EP disclosed
WO-2012011125-A1 AGONISTS OF GPR40 CONNEXIOS LIFE SCIENCES PVT. LTD. (IN) 2012-01-26 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-20130237571-A1 AGONISTS OF GPR40 GPR65, GPR55, GPR68 DRD4 2029/4885ALDH1A1 2410/4885ERCC5 4394/4885

“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.