SCHEMBL7229252

SCHEMBL7229252

OC(CBr)c1ccc2ccccc2c1

nearest known ligand 0.60

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 5/20 0.57
MEN1 O00255 2/20 0.57
KMT2A Q03164 2/20 0.57
CYP1A2 P05177 2/20 0.57
AOC3 Q16853 1/20 0.57
TSHR P16473 1/20 0.57
HIF1A Q16665 1/20 0.57
UGT2B7 P16662 1/20 0.57
SLC6A2 P23975 11/20 0.53
SLC6A4 P31645 11/20 0.53
SLC6A3 Q01959 11/20 0.53
KCNH2 Q12809 7/20 0.53
CYP3A4 P08684 2/20 0.53
HDAC1 Q13547 1/20 0.49
HDAC8 Q9BY41 1/20 0.49
ATM Q13315 1/20 0.49

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
SCHEMBL3266869 0.83 UGT2B7 (0.61) CYP2D6MEN1KMT2ACYP1A2AOC3
SCHEMBL6490271 0.82 CYP2D6 (0.59) CYP2D6MEN1KMT2ACYP1A2AOC3
SCHEMBL6543395 0.82 CYP2D6 (0.59) CYP2D6MEN1KMT2ACYP1A2AOC3
SCHEMBL2894556 0.82 CYP2D6 (0.59) CYP2D6MEN1KMT2ACYP1A2AOC3
SCHEMBL4945583 0.80 SLC6A2 (0.62) CYP2D6MEN1KMT2ACYP1A2AOC3
SCHEMBL4945588 0.80 SLC6A2 (0.62) CYP2D6MEN1KMT2ACYP1A2AOC3
SCHEMBL894256 0.80 CYP2D6 (0.57) CYP2D6MEN1KMT2ACYP1A2AOC3
SCHEMBL10120474 0.80 UGT2B7 (0.62) CYP2D6MEN1KMT2ACYP1A2AOC3
SCHEMBL483715 0.80 UGT2B7 (0.62) CYP2D6MEN1KMT2ACYP1A2AOC3
SCHEMBL30353291 0.80 SLC6A2 (0.62) CYP2D6MEN1KMT2ACYP1A2AOC3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030055263-A1 Carboxylic acid derivatives, medicaments comprising these compounds, their use and processes for their production BOEHRINGER INGELHEIM PHARMA KG (DE) 2003-03-20 US disclosed
WO-2003006443-A2 2- 4-(NAPHTALIN-2-YL)-THIAZOL-2-YLAMINOCARBONYL BENZOIC ACID AND 2- 4-(NAPHTALIN-2-YL)-PYRIMIDIN-2-YLAMINOCARBONYL BENZOIC ACID AND ADDITIONAL COMPOUNDS SERVING AS TELOMERASE INHIBITORS FOR USE IN TUMOR THERAPY BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2003-01-23 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-20030055263-A1 Carboxylic acid derivatives, medicaments comprising these compounds, their use and processes for their production TERT, POT1, REV1 CYP2D6 1582/4885MEN1 386/4885KMT2A 2592/4885

“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.